Reagent: 3
Reactant Smiles: CC(=CC1=C[CH+][C@H](C=C1)[C@@]2(C=CC=C[C@H]2C(C)(C)Cc3ccccc3)C=C(C)C)C
Highest priority first:

Priority: 7084

CC(=CC1=C[CH+:20][C@H](C=C1)[C@@]2(C=C[CH:10]=[CH:11][C@H]2C(C)(C)Cc3ccccc3)C=C(C)C)C>>CC(=CC1=C[CH:20]2[CH:10]3C=C[C@@]([C@H]2C=C1)([C@@H]([CH+:11]3)C(C)(C)Cc4ccccc4)C=C(C)C)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(=CC1=C[CH+:20][C@H](C=C1)[C@@]2(C=C[CH:10]=[CH:11][C@H]2C(C)(C)Cc3ccccc3)C=C(C)C)C>>CC(=CC1=C[CH:20]2[CH:10]3C=C[C@@]([C@H]2C=C1)([C@@H]([CH+:11]3)C(C)(C)Cc4ccccc4)C=C(C)C)C 10,11=10,20

Priority: 7082

CC(=CC1=C[CH+:20][C@H](C=C1)[C@@]2(C=CC=C[C@H]2C(C)(C)Cc3ccccc3)[CH:11]=[C:10](C)C)C>>CC(=CC1=C[CH:20]2[C@H](C=C1)[C@@]3(C=CC=C[C@H]3C(C)(C)Cc4ccccc4)[CH+:11][C:10]2(C)C)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(=CC1=C[CH+:20][C@H](C=C1)[C@@]2(C=CC=C[C@H]2C(C)(C)Cc3ccccc3)[CH:11]=[C:10](C)C)C>>CC(=CC1=C[CH:20]2[C@H](C=C1)[C@@]3(C=CC=C[C@H]3C(C)(C)Cc4ccccc4)[CH+:11][C:10]2(C)C)C 10,11=10,20

Priority: 7030

CC(=C[C:11]1=[CH:10][CH+:20][C@H](C=C1)[C@@]2(C=CC=C[C@H]2C(C)(C)Cc3ccccc3)C=C(C)C)C>>CC(=C[C+:11]1[CH:10]=[CH:20][C@H](C=C1)[C@@]2(C=CC=C[C@H]2C(C)(C)Cc3ccccc3)C=C(C)C)C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CC(=C[C:11]1=[CH:10][CH+:20][C@H](C=C1)[C@@]2(C=CC=C[C@H]2C(C)(C)Cc3ccccc3)C=C(C)C)C>>CC(=C[C+:11]1[CH:10]=[CH:20][C@H](C=C1)[C@@]2(C=CC=C[C@H]2C(C)(C)Cc3ccccc3)C=C(C)C)C 10,11=10,20

Reagent: 3
Reactant Smiles: C[C@@H](c1ccccc1)[C@@H]2C=CC(=C[C@H]2[C@@H]3C=C(C=C[CH+]3)C=C)C=C.C[C@H]([C@@H]1C=CC(=C[C@H]1[C@@H]2C=C(C=C[CH+]2)C=C)C=C)C3=CC=CC=C3
Highest priority first:

Priority: 2500

C[C@@H](c1ccccc1)[C@@H]2C=CC(=C[C@H]2[C@@H]3C=C(C=C[CH+:20]3)C=C)C=C.C[C@H]([C@@H]1C=CC(=C[C@H]1[C@@H]2C=C(C=C[CH+]2)C=C)C=C)[C:13]3=[CH:12][CH:11]=[CH:10]C=C3>>C[C@@H](c1ccccc1)[C@@H]2C=CC(=C[C@H]2[C@@H]3C=C(C=C[CH:20]3[CH:10]4[CH:11]=[CH:12][C+:13](C=C4)[C@H](C)[C@@H]5C=CC(=C[C@H]5[C@@H]6C=C(C=C[CH+]6)C=C)C=C)C=C)C=C
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C C[C@@H](c1ccccc1)[C@@H]2C=CC(=C[C@H]2[C@@H]3C=C(C=C[CH+:20]3)C=C)C=C.C[C@H]([C@@H]1C=CC(=C[C@H]1[C@@H]2C=C(C=C[CH+]2)C=C)C=C)[C:13]3=[CH:12][CH:11]=[CH:10]C=C3>>C[C@@H](c1ccccc1)[C@@H]2C=CC(=C[C@H]2[C@@H]3C=C(C=C[CH:20]3[CH:10]4[CH:11]=[CH:12][C+:13](C=C4)[C@H](C)[C@@H]5C=CC(=C[C@H]5[C@@H]6C=C(C=C[CH+]6)C=C)C=C)C=C)C=C 10,11=10,20;12,13=11,12

Priority: 2000

C[C@@H](c1ccccc1)[C@@H]2C=CC(=C[C@H]2[C@@H]3C=C(C=C[CH+:20]3)C=C)C=C.C[C@H]([C@@H]1C=CC(=C[C@H]1[C@@H]2C=C(C=C[CH+]2)C=C)C=C)C3=C[CH:10]=[CH:11]C=C3>>C[C@@H](c1ccccc1)[C@@H]2C=CC(=C[C@H]2[C@@H]3C=C(C=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)[C@H](C)[C@@H]5C=CC(=C[C@H]5[C@@H]6C=C(C=C[CH+]6)C=C)C=C)C=C)C=C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C@@H](c1ccccc1)[C@@H]2C=CC(=C[C@H]2[C@@H]3C=C(C=C[CH+:20]3)C=C)C=C.C[C@H]([C@@H]1C=CC(=C[C@H]1[C@@H]2C=C(C=C[CH+]2)C=C)C=C)C3=C[CH:10]=[CH:11]C=C3>>C[C@@H](c1ccccc1)[C@@H]2C=CC(=C[C@H]2[C@@H]3C=C(C=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)[C@H](C)[C@@H]5C=CC(=C[C@H]5[C@@H]6C=C(C=C[CH+]6)C=C)C=C)C=C)C=C 10,11=10,20

Reagent: 8
Reactant Smiles: C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=CC=CC=C4)OC.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Priority: 2955

C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5)OC.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5)OC.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C:11]4=[CH:10]C=CC=C4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5)OC.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C:11]4=[CH:10]C=CC=C4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5)OC.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=CC=C[CH:10]=[CH:11]4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5)OC.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=CC=C[CH:10]=[CH:11]4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5)OC.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=C[CH:10]=[CH:11]C=C4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5)OC.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=C[CH:10]=[CH:11]C=C4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5)OC.[Cl-] 10,11=10,20;20,21=21

Reagent: 3
Reactant Smiles: CC(C)[C@H](c1ccccc1)[C@@H]2C=C[CH+]C=C2C=C(C)C.CC(C)[C@@H]([C@@H]1C=C[CH+]C=C1C=C(C)C)C2=CC=CC=C2
Highest priority first:

Priority: 2500

CC(C)[C@H](c1ccccc1)[C@@H]2C=C[CH+:20]C=C2C=C(C)C.CC(C)[C@@H]([C@@H]1C=C[CH+]C=C1C=C(C)C)[C:13]2=[CH:12][CH:11]=[CH:10]C=C2>>CC(C)[C@H](c1ccccc1)[C@@H]2C=C[CH:20](C=C2C=C(C)C)[CH:10]3[CH:11]=[CH:12][C+:13](C=C3)[C@H]([C@@H]4C=C[CH+]C=C4C=C(C)C)C(C)C
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(C)[C@H](c1ccccc1)[C@@H]2C=C[CH+:20]C=C2C=C(C)C.CC(C)[C@@H]([C@@H]1C=C[CH+]C=C1C=C(C)C)[C:13]2=[CH:12][CH:11]=[CH:10]C=C2>>CC(C)[C@H](c1ccccc1)[C@@H]2C=C[CH:20](C=C2C=C(C)C)[CH:10]3[CH:11]=[CH:12][C+:13](C=C3)[C@H]([C@@H]4C=C[CH+]C=C4C=C(C)C)C(C)C 10,11=10,20;12,13=11,12

Priority: 2000

CC(C)[C@H](c1ccccc1)[C@@H]2C=C[CH+:20]C=C2C=C(C)C.CC(C)[C@@H]([C@@H]1C=C[CH+]C=C1C=C(C)C)C2=C[CH:10]=[CH:11]C=C2>>CC(C)[C@H](c1ccccc1)[C@@H]2C=C[CH:20](C=C2C=C(C)C)[CH:10]3C=C(C=C[CH+:11]3)[C@H]([C@@H]4C=C[CH+]C=C4C=C(C)C)C(C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H](c1ccccc1)[C@@H]2C=C[CH+:20]C=C2C=C(C)C.CC(C)[C@@H]([C@@H]1C=C[CH+]C=C1C=C(C)C)C2=C[CH:10]=[CH:11]C=C2>>CC(C)[C@H](c1ccccc1)[C@@H]2C=C[CH:20](C=C2C=C(C)C)[CH:10]3C=C(C=C[CH+:11]3)[C@H]([C@@H]4C=C[CH+]C=C4C=C(C)C)C(C)C 10,11=10,20

Reagent: 3
Reactant Smiles: CC(C)[C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH+]2)N)[NH3+].C1=CC=C(C=C1)N
Highest priority first:

Priority: 2950

CC(C)[C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH+:20]2)N)[NH3+].C1=C[CH:10]=[C:11](C=C1)N>>CC(C)[C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH:20]2[CH:10]3C=CC=C[C+:11]3N)N)[NH3+]
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH+:20]2)N)[NH3+].C1=C[CH:10]=[C:11](C=C1)N>>CC(C)[C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH:20]2[CH:10]3C=CC=C[C+:11]3N)N)[NH3+] 10,11=10,20

Priority: 2000

CC(C)[C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH+:20]2)N)[NH3+].C1=CC=C([CH:11]=[CH:10]1)N>>CC(C)[C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH:20]2[CH:10]3C=CC=C([CH+:11]3)N)N)[NH3+]
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH+:20]2)N)[NH3+].C1=CC=C([CH:11]=[CH:10]1)N>>CC(C)[C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH:20]2[CH:10]3C=CC=C([CH+:11]3)N)N)[NH3+] 10,11=10,20

Reagent: 3
Reactant Smiles: [1H]OS(=O)(=O)O.CC(C)[C@H](c1ccccc1)[C@@H]\2C=CC=C/C2=C\[C+](C)C
Highest priority first:

Priority: 2020 $[H:20][O:21]S(=O)(=O)O.CC(C)[C@H](c1ccccc1)[C@@H]\2C=C[CH:11]=[CH:10]/C2=C\[C+](C)C>>[H:20][CH:10]\1[CH+:11]C=C[C@H](/C1=C/[C+](C)C)[C@@H](c2ccccc2)C(C)C.OS(=O)(=O)[O-:21]$
[H:20][O:21]S(=O)(=O)O.CC(C)[C@H](c1ccccc1)[C@@H]\2C=C[CH:11]=[CH:10]/C2=C\[C+](C)C>>[H:20][CH:10]\1[CH+:11]C=C[C@H](/C1=C/[C+](C)C)[C@@H](c2ccccc2)C(C)C.OS(=O)(=O)[O-:21]
( 1 pi 2 2 3 sigma 4 2 )
π_C=C > σ^*_H-O [H:20][O:21]S(=O)(=O)O.CC(C)[C@H](c1ccccc1)[C@@H]\2C=C[CH:11]=[CH:10]/C2=C\[C+](C)C>>[H:20][CH:10]\1[CH+:11]C=C[C@H](/C1=C/[C+](C)C)[C@@H](c2ccccc2)C(C)C.OS(=O)(=O)[O-:21] 10,11=10,20;20,21=21

Priority: 2010 $[H:20][O:21]S(=O)(=O)O.CC(C)[C@H](c1ccccc1)[C@@H]\2[CH:11]=[CH:10]C=C/C2=C\[C+](C)C>>[H:20][CH:10]1C=C/C(=C\[C+](C)C)/[C@@H]([CH+:11]1)[C@@H](c2ccccc2)C(C)C.OS(=O)(=O)[O-:21]$
[H:20][O:21]S(=O)(=O)O.CC(C)[C@H](c1ccccc1)[C@@H]\2[CH:11]=[CH:10]C=C/C2=C\[C+](C)C>>[H:20][CH:10]1C=C/C(=C\[C+](C)C)/[C@@H]([CH+:11]1)[C@@H](c2ccccc2)C(C)C.OS(=O)(=O)[O-:21]
( 1 pi 2 2 3 sigma 4 2 )
π_C=C > σ^*_H-O [H:20][O:21]S(=O)(=O)O.CC(C)[C@H](c1ccccc1)[C@@H]\2[CH:11]=[CH:10]C=C/C2=C\[C+](C)C>>[H:20][CH:10]1C=C/C(=C\[C+](C)C)/[C@@H]([CH+:11]1)[C@@H](c2ccccc2)C(C)C.OS(=O)(=O)[O-:21] 10,11=10,20;20,21=21

Reagent: 28
Reactant Smiles: C[C+]=O.C1=COC(=C1)C#N
Highest priority first:

Priority: 2925

C[C+:20]=O.[CH:11]1=[CH:10]OC(=C1)C#N>>C[C:20](=O)[CH:10]1[CH+:11]C=C(O1)C#N
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C+:20]=O.[CH:11]1=[CH:10]OC(=C1)C#N>>C[C:20](=O)[CH:10]1[CH+:11]C=C(O1)C#N 10,11=10,20

Priority: 2920

C[C+:20]=O.C1=CO[C:11](=[CH:10]1)C#N>>C[C:20](=O)[CH:10]1C=CO[C+:11]1C#N
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C+:20]=O.C1=CO[C:11](=[CH:10]1)C#N>>C[C:20](=O)[CH:10]1C=CO[C+:11]1C#N 10,11=10,20

Priority: 2731

C[C+:20]=O.[CH:10]1=COC(=[CH:11]1)C#N>>C[C:20](=O)[CH:10]=COC(=[CH+:11])C#N
( 3 sigma 2 2 5 p None 0 )
σ_C-C > p_C C[C+:20]=O.[CH:10]1=COC(=[CH:11]1)C#N>>C[C:20](=O)[CH:10]=COC(=[CH+:11])C#N 10,11=10,20

Priority: 2500

C[C+:20]=O.[CH:11]1=[CH:10]O[C:13](=[CH:12]1)C#N>>C[C:20](=O)[CH:10]1[CH:11]=[CH:12][C+:13](O1)C#N
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C C[C+:20]=O.[CH:11]1=[CH:10]O[C:13](=[CH:12]1)C#N>>C[C:20](=O)[CH:10]1[CH:11]=[CH:12][C+:13](O1)C#N 10,11=10,20;12,13=11,12

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C+](c4c3cccc4)C(F)(F)F)cccc2C(F)(F)F.CC(C)[C@@H]1C=C2C(=C[C@@H]1[C@@H]3C=C[C+](c4c3cccc4)C(F)(F)F)C=CC=C2C(F)(F)F
Highest priority first:

Priority: 2751

CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C+:20](c4c3cccc4)C(F)(F)F)cccc2C(F)(F)F.CC(C)[C@@H]1C=C2C(=C[C@@H]1[C@@H]3C=C[C+](c4c3cccc4)C(F)(F)F)C=[CH:10][CH:11]=C2C(F)(F)F>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C:20](c4c3cccc4)([CH:10]=CC5=C[C@@H]([C@@H](C=C5C(=[CH+:11])C(F)(F)F)C(C)C)[C@@H]6C=C[C+](c7c6cccc7)C(F)(F)F)C(F)(F)F)cccc2C(F)(F)F
( 3 sigma 2 2 5 p None 0 )
σ_C-C > p_C CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C+:20](c4c3cccc4)C(F)(F)F)cccc2C(F)(F)F.CC(C)[C@@H]1C=C2C(=C[C@@H]1[C@@H]3C=C[C+](c4c3cccc4)C(F)(F)F)C=[CH:10][CH:11]=C2C(F)(F)F>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C:20](c4c3cccc4)([CH:10]=CC5=C[C@@H]([C@@H](C=C5C(=[CH+:11])C(F)(F)F)C(C)C)[C@@H]6C=C[C+](c7c6cccc7)C(F)(F)F)C(F)(F)F)cccc2C(F)(F)F 10,11=10,20

Priority: 2500

CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C+:20](c4c3cccc4)C(F)(F)F)cccc2C(F)(F)F.CC(C)[C@@H]1C=C2C(=C[C@@H]1[C@@H]3C=C[C+](c4c3cccc4)C(F)(F)F)[CH:10]=[CH:11][CH:12]=[C:13]2C(F)(F)F>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C:20](c4c3cccc4)([CH:10]5[CH:11]=[CH:12][C+:13](C6=C[C@H]([C@H](C=C56)[C@@H]7C=C[C+](c8c7cccc8)C(F)(F)F)C(C)C)C(F)(F)F)C(F)(F)F)cccc2C(F)(F)F
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C+:20](c4c3cccc4)C(F)(F)F)cccc2C(F)(F)F.CC(C)[C@@H]1C=C2C(=C[C@@H]1[C@@H]3C=C[C+](c4c3cccc4)C(F)(F)F)[CH:10]=[CH:11][CH:12]=[C:13]2C(F)(F)F>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C:20](c4c3cccc4)([CH:10]5[CH:11]=[CH:12][C+:13](C6=C[C@H]([C@H](C=C56)[C@@H]7C=C[C+](c8c7cccc8)C(F)(F)F)C(C)C)C(F)(F)F)C(F)(F)F)cccc2C(F)(F)F 10,11=10,20;12,13=11,12

Priority: 2000

CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C+:20](c4c3cccc4)C(F)(F)F)cccc2C(F)(F)F.CC(C)[C@@H]1C=C2C(=C[C@@H]1[C@@H]3C=C[C+](c4c3cccc4)C(F)(F)F)C=C[CH:10]=[C:11]2C(F)(F)F>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C:20](c4c3cccc4)([CH:10]5C=CC6=C[C@@H]([C@@H](C=C6[C+:11]5C(F)(F)F)C(C)C)[C@@H]7C=C[C+](c8c7cccc8)C(F)(F)F)C(F)(F)F)cccc2C(F)(F)F
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C+:20](c4c3cccc4)C(F)(F)F)cccc2C(F)(F)F.CC(C)[C@@H]1C=C2C(=C[C@@H]1[C@@H]3C=C[C+](c4c3cccc4)C(F)(F)F)C=C[CH:10]=[C:11]2C(F)(F)F>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C:20](c4c3cccc4)([CH:10]5C=CC6=C[C@@H]([C@@H](C=C6[C+:11]5C(F)(F)F)C(C)C)[C@@H]7C=C[C+](c8c7cccc8)C(F)(F)F)C(F)(F)F)cccc2C(F)(F)F 10,11=10,20

Reagent: 27
Reactant Smiles: CCOC(=O)[C@@](Cc1ccccc1)([C@]([OH2+])(O)OCC)N[C@](C)([OH2+])O
Highest priority first:

Priority: 6973

CCOC(=O)[C@@](Cc1ccccc1)([C@]([OH2+])(O)OCC)N[C@:20](C)([OH2+:21])[OH:10]>>CCOC(=O)[C@@](Cc1ccccc1)([C@]([OH2+])(O)OCC)N[C@:20](=[OH+:10])C.[OH2:21]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-O CCOC(=O)[C@@](Cc1ccccc1)([C@]([OH2+])(O)OCC)N[C@:20](C)([OH2+:21])[OH:10]>>CCOC(=O)[C@@](Cc1ccccc1)([C@]([OH2+])(O)OCC)N[C@:20](=[OH+:10])C.[OH2:21] 10=20;20,21=21

Priority: 6972

CCOC(=O)[C@@](Cc1ccccc1)([C@]([OH2+])(O)OCC)[NH:10][C@:20](C)([OH2+:21])O>>CCOC(=O)[C@@](Cc1ccccc1)([C@]([OH2+])(O)OCC)[NH+:10]=[C@:20](C)O.[OH2:21]
( 2 sp3 None 2 1 sigma 8 2 )
n_N > σ^*_C-O CCOC(=O)[C@@](Cc1ccccc1)([C@]([OH2+])(O)OCC)[NH:10][C@:20](C)([OH2+:21])O>>CCOC(=O)[C@@](Cc1ccccc1)([C@]([OH2+])(O)OCC)[NH+:10]=[C@:20](C)O.[OH2:21] 10=20;20,21=21

Priority: 6970

CCOC(=O)[C@@](Cc1ccccc1)([C@:20]([OH2+:21])(O)[O:10]CC)N[C@](C)([OH2+])O>>CCOC(=O)[C@@](Cc1ccccc1)([C@@:20](=[O+:10]CC)O)N[C@](C)([OH2+])O.[OH2:21]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-O CCOC(=O)[C@@](Cc1ccccc1)([C@:20]([OH2+:21])(O)[O:10]CC)N[C@](C)([OH2+])O>>CCOC(=O)[C@@](Cc1ccccc1)([C@@:20](=[O+:10]CC)O)N[C@](C)([OH2+])O.[OH2:21] 10=20;20,21=21

Priority: 4100

CCOC(=O)[C@@](Cc1ccccc1)([C@:20]([OH2+:21])(O)OCC)N[C@](C)([OH2+])O>>CCOC(=O)[C@@](Cc1ccccc1)([C@+:20](O)OCC)N[C@](C)([OH2+])O.[OH2:21]
( 1 sigma 2 2 1 sigma 2 2 )
σ_C-O > σ^*_C-O CCOC(=O)[C@@](Cc1ccccc1)([C@:20]([OH2+:21])(O)OCC)N[C@](C)([OH2+])O>>CCOC(=O)[C@@](Cc1ccccc1)([C@+:20](O)OCC)N[C@](C)([OH2+])O.[OH2:21] 20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=CC=C2[C@]1(C=CC=C2C(=O)C)[C@@H]3C=c4c(=C[CH+]3)cccc4C(=O)C
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[CH:10]C=C2[C@]1(C=CC=C2C(=O)C)[C@@H]3C=c4c(=C[CH+:20]3)cccc4C(=O)C>>CC(C)[C@H]1[CH+:11][CH:10]2C=C3[C@]1(C=CC=C3C(=O)C)[C@H]4[CH:20]2C=c5cccc(c5=C4)C(=O)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[CH:10]C=C2[C@]1(C=CC=C2C(=O)C)[C@@H]3C=c4c(=C[CH+:20]3)cccc4C(=O)C>>CC(C)[C@H]1[CH+:11][CH:10]2C=C3[C@]1(C=CC=C3C(=O)C)[C@H]4[CH:20]2C=c5cccc(c5=C4)C(=O)C 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=CC=C2[C@]1([CH:11]=[CH:10]C=C2C(=O)C)[C@@H]3C=c4c(=C[CH+:20]3)cccc4C(=O)C>>CC(C)[C@H]1C=CC=C2[C@@]13[CH+:11][CH:10](C=C2C(=O)C)[CH:20]4[C@H]3C=c5c(=C4)cccc5C(=O)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC=C2[C@]1([CH:11]=[CH:10]C=C2C(=O)C)[C@@H]3C=c4c(=C[CH+:20]3)cccc4C(=O)C>>CC(C)[C@H]1C=CC=C2[C@@]13[CH+:11][CH:10](C=C2C(=O)C)[CH:20]4[C@H]3C=c5c(=C4)cccc5C(=O)C 10,11=10,20

Reagent: 66
Reactant Smiles: CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+]2)C)C(C)C
Highest priority first:

Priority: 7084

C[C:10]1=[CH:11][C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+:20]2)C)C(C)C>>CC1=CC=C[C@@H]2[CH:20]1[C:10]3(C=C[C@H]2[C@H]([CH+:11]3)C(C)C)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C C[C:10]1=[CH:11][C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+:20]2)C)C(C)C>>CC1=CC=C[C@@H]2[CH:20]1[C:10]3(C=C[C@H]2[C@H]([CH+:11]3)C(C)C)C 10,11=10,20

Priority: 7082

CC1=C[C@@H]([C@H]([CH:11]=[CH:10]1)[C@@H]2C=CC=C([CH+:20]2)C)C(C)C>>CC1=CC=C[C@@H]2[CH:20]1[CH:10]3[CH+:11][C@H]2[C@H](C=C3C)C(C)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC1=C[C@@H]([C@H]([CH:11]=[CH:10]1)[C@@H]2C=CC=C([CH+:20]2)C)C(C)C>>CC1=CC=C[C@@H]2[CH:20]1[CH:10]3[CH+:11][C@H]2[C@H](C=C3C)C(C)C 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=CC=C2[C@]1(C=CC(=C2)C(F)(F)F)[C@H]3[CH+]C=Cc4c3ccc(c4)C(F)(F)F
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[CH:10]C=C2[C@]1(C=CC(=C2)C(F)(F)F)[C@H]3[CH+:20]C=Cc4c3ccc(c4)C(F)(F)F>>CC(C)[C@H]1[CH+:11][CH:10]2C=C3[C@]1(C=CC(=C3)C(F)(F)F)[C@H]4[CH:20]2C=Cc5c4ccc(c5)C(F)(F)F
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[CH:10]C=C2[C@]1(C=CC(=C2)C(F)(F)F)[C@H]3[CH+:20]C=Cc4c3ccc(c4)C(F)(F)F>>CC(C)[C@H]1[CH+:11][CH:10]2C=C3[C@]1(C=CC(=C3)C(F)(F)F)[C@H]4[CH:20]2C=Cc5c4ccc(c5)C(F)(F)F 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=CC=C2[C@]1([CH:11]=[CH:10]C(=C2)C(F)(F)F)[C@H]3[CH+:20]C=Cc4c3ccc(c4)C(F)(F)F>>CC(C)[C@H]1C=CC=C2[C@@]13[CH+:11][CH:10]([CH:20]4[C@H]3c5ccc(cc5C=C4)C(F)(F)F)C(=C2)C(F)(F)F
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC=C2[C@]1([CH:11]=[CH:10]C(=C2)C(F)(F)F)[C@H]3[CH+:20]C=Cc4c3ccc(c4)C(F)(F)F>>CC(C)[C@H]1C=CC=C2[C@@]13[CH+:11][CH:10]([CH:20]4[C@H]3c5ccc(cc5C=C4)C(F)(F)F)C(=C2)C(F)(F)F 10,11=10,20

Reagent: 28
Reactant Smiles: CC(=O)[C@@H]1[CH+]C=Cc2c1cccc2C(F)(F)F.c1ccc2=C(C=CC=c2c1)C(F)(F)F
Highest priority first:

Priority: 2751

CC(=O)[C@@H]1[CH+:20]C=Cc2c1cccc2C(F)(F)F.c1ccc2=C([CH:11]=[CH:10]C=c2c1)C(F)(F)F>>CC(=O)[C@H]1c2cccc(c2C=C[CH:20]1[CH:10]3C=c4ccccc4=C([CH+:11]3)C(F)(F)F)C(F)(F)F
( 3 pi 2 2 5 p None 0 )
π_C=C > p_C CC(=O)[C@@H]1[CH+:20]C=Cc2c1cccc2C(F)(F)F.c1ccc2=C([CH:11]=[CH:10]C=c2c1)C(F)(F)F>>CC(=O)[C@H]1c2cccc(c2C=C[CH:20]1[CH:10]3C=c4ccccc4=C([CH+:11]3)C(F)(F)F)C(F)(F)F 10,11=10,20

Priority: 2000

CC(=O)[C@@H]1[CH+:20]C=Cc2c1cccc2C(F)(F)F.c1ccc2=C([CH:11]=[CH:10]C=c2c1)C(F)(F)F>>CC(=O)[C@H]1c2cccc(c2C=C[CH:20]1[CH:10]3C=c4ccccc4=C([CH+:11]3)C(F)(F)F)C(F)(F)F
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(=O)[C@@H]1[CH+:20]C=Cc2c1cccc2C(F)(F)F.c1ccc2=C([CH:11]=[CH:10]C=c2c1)C(F)(F)F>>CC(=O)[C@H]1c2cccc(c2C=C[CH:20]1[CH:10]3C=c4ccccc4=C([CH+:11]3)C(F)(F)F)C(F)(F)F 10,11=10,20

Reagent: 3
Reactant Smiles: CC(C)[C@H]1C=CC=C[C@@]1(C=C)[C@@H]2C=CC=C([CH+]2)C=C
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[CH:10]C=C[C@@]1(C=C)[C@@H]2C=CC=C([CH+:20]2)C=C>>CC(C)[C@H]1[CH+:11][CH:10]2C=C[C@]1([C@H]3[CH:20]2C(=CC=C3)C=C)C=C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[CH:10]C=C[C@@]1(C=C)[C@@H]2C=CC=C([CH+:20]2)C=C>>CC(C)[C@H]1[CH+:11][CH:10]2C=C[C@]1([C@H]3[CH:20]2C(=CC=C3)C=C)C=C 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=CC=C[C@@]1([CH:11]=[CH2:10])[C@@H]2C=CC=C([CH+:20]2)C=C>>CC(C)[C@H]1C=CC=C[C@]12[CH+:11][CH2:10][CH:20]3[C@H]2C=CC=C3C=C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC=C[C@@]1([CH:11]=[CH2:10])[C@@H]2C=CC=C([CH+:20]2)C=C>>CC(C)[C@H]1C=CC=C[C@]12[CH+:11][CH2:10][CH:20]3[C@H]2C=CC=C3C=C 10,11=10,20

Priority: 7030

CC(C)[C@H]1C=CC=C[C@@]1(C=C)[C@@H]2C=C[CH:11]=[C:10]([CH+:20]2)C=C>>CC(C)[C@H]1C=CC=C[C@@]1(C=C)[C@@H]2C=C[CH+:11][C:10](=[CH:20]2)C=C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC=C[C@@]1(C=C)[C@@H]2C=C[CH:11]=[C:10]([CH+:20]2)C=C>>CC(C)[C@H]1C=CC=C[C@@]1(C=C)[C@@H]2C=C[CH+:11][C:10](=[CH:20]2)C=C 10,11=10,20

Reagent: 8
Reactant Smiles: C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=CC=CC=C4)OC.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Priority: 2955

C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5)OC.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5)OC.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C:11]4=[CH:10]C=CC=C4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5)OC.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C:11]4=[CH:10]C=CC=C4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5)OC.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=CC=C[CH:10]=[CH:11]4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5)OC.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=CC=C[CH:10]=[CH:11]4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5)OC.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=C[CH:10]=[CH:11]C=C4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5)OC.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=C[CH:10]=[CH:11]C=C4)OC.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5)OC.[Cl-] 10,11=10,20;20,21=21

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]
Highest priority first:

Priority: 2955

c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-] 10,11=10,20;20,21=21

Reagent: 3
Reactant Smiles: C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C+]2C#C)/C=C/c3ccccc3.C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C+]2C#C)/C=C/C3=CC=CC=C3
Highest priority first:

Priority: 2500

C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C+:20]2C#C)/C=C/c3ccccc3.C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C+]2C#C)/C=C/[C:11]3=[CH:10]C=CC=C3>>C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C:20]2(C#C)[CH:10]3C=CC=C[C+:11]3/C=C/[C@H]4C=CC=C([C@@H]4[C@@H]5C=CC=C[C+]5C#C)C#C)/C=C/c6ccccc6
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C+:20]2C#C)/C=C/c3ccccc3.C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C+]2C#C)/C=C/[C:11]3=[CH:10]C=CC=C3>>C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C:20]2(C#C)[CH:10]3C=CC=C[C+:11]3/C=C/[C@H]4C=CC=C([C@@H]4[C@@H]5C=CC=C[C+]5C#C)C#C)/C=C/c6ccccc6 10,11=10,20

Priority: 2000

C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C+:20]2C#C)/C=C/c3ccccc3.C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C+]2C#C)/C=C/C3=C[CH:10]=[CH:11]C=C3>>C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C:20]2(C#C)[CH:10]3C=C(C=C[CH+:11]3)/C=C/[C@H]4C=CC=C([C@@H]4[C@@H]5C=CC=C[C+]5C#C)C#C)/C=C/c6ccccc6
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C+:20]2C#C)/C=C/c3ccccc3.C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C+]2C#C)/C=C/C3=C[CH:10]=[CH:11]C=C3>>C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C:20]2(C#C)[CH:10]3C=C(C=C[CH+:11]3)/C=C/[C@H]4C=CC=C([C@@H]4[C@@H]5C=CC=C[C+]5C#C)C#C)/C=C/c6ccccc6 10,11=10,20

Reagent: 8
Reactant Smiles: CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Priority: 2955

CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Reagent: 140
Reactant Smiles: [1H]C1CC[C@H](C1=O)[C@H](C)O.CC[O-]
Highest priority first:

Priority: 4378

[H:20][CH:21]1CC[C@H]([C:22]1=[O:23])[C@H](C)O.CC[O-:10]>>[H:20][O:10]CC.C[C@@H]([C@@H]1CC[CH:21]=[C:22]1[O-:23])O
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH:21]1CC[C@H]([C:22]1=[O:23])[C@H](C)O.CC[O-:10]>>[H:20][O:10]CC.C[C@@H]([C@@H]1CC[CH:21]=[C:22]1[O-:23])O 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][CH:21]1CC[C@H](C1=O)[C@H](C)O.CC[O-:10]>>[H:20][O:10]CC.C[C@@H]([C@@H]1CC[CH-:21]C1=O)O
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH:21]1CC[C@H](C1=O)[C@H](C)O.CC[O-:10]>>[H:20][O:10]CC.C[C@@H]([C@@H]1CC[CH-:21]C1=O)O 10=20;20,21=21

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=CC(=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]
Highest priority first:

Priority: 2955

c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@@H]2C=CC(=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@@H]2C=CC(=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@@H]2C=CC(=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@@H]2C=CC(=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC(=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC(=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC(=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC(=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5C=CS[CH+]5.[Cl-] 10,11=10,20;20,21=21

Reagent: 8
Reactant Smiles: CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Priority: 2955

CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Reagent: 3
Reactant Smiles: CC[C@@H](c1ccccc1)[C@H]2C=C(C=C[C@@H]2[C@H]3C=CC=C([CH+]3)/C=C/C)/C=C/C.CC[C@H]([C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)C3=CC=CC=C3
Highest priority first:

Priority: 2500

CC[C@@H](c1ccccc1)[C@H]2C=C(C=C[C@@H]2[C@H]3C=CC=C([CH+:20]3)/C=C/C)/C=C/C.CC[C@H]([C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)[C:13]3=[CH:12][CH:11]=[CH:10]C=C3>>CC[C@@H](c1ccccc1)[C@H]2C=C(C=C[C@@H]2[C@H]3C=CC=C([CH:20]3[CH:10]4[CH:11]=[CH:12][C+:13](C=C4)[C@H](CC)[C@H]5C=C(C=C[C@@H]5[C@H]6C=CC=C([CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC[C@@H](c1ccccc1)[C@H]2C=C(C=C[C@@H]2[C@H]3C=CC=C([CH+:20]3)/C=C/C)/C=C/C.CC[C@H]([C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)[C:13]3=[CH:12][CH:11]=[CH:10]C=C3>>CC[C@@H](c1ccccc1)[C@H]2C=C(C=C[C@@H]2[C@H]3C=CC=C([CH:20]3[CH:10]4[CH:11]=[CH:12][C+:13](C=C4)[C@H](CC)[C@H]5C=C(C=C[C@@H]5[C@H]6C=CC=C([CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C 10,11=10,20;12,13=11,12

Priority: 2000

CC[C@@H](c1ccccc1)[C@H]2C=C(C=C[C@@H]2[C@H]3C=CC=C([CH+:20]3)/C=C/C)/C=C/C.CC[C@H]([C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)C3=C[CH:10]=[CH:11]C=C3>>CC[C@@H](c1ccccc1)[C@H]2C=C(C=C[C@@H]2[C@H]3C=CC=C([CH:20]3[CH:10]4C=C(C=C[CH+:11]4)[C@H](CC)[C@H]5C=C(C=C[C@@H]5[C@H]6C=CC=C([CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC[C@@H](c1ccccc1)[C@H]2C=C(C=C[C@@H]2[C@H]3C=CC=C([CH+:20]3)/C=C/C)/C=C/C.CC[C@H]([C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)C3=C[CH:10]=[CH:11]C=C3>>CC[C@@H](c1ccccc1)[C@H]2C=C(C=C[C@@H]2[C@H]3C=CC=C([CH:20]3[CH:10]4C=C(C=C[CH+:11]4)[C@H](CC)[C@H]5C=C(C=C[C@@H]5[C@H]6C=CC=C([CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C 10,11=10,20

Reagent: 3
Reactant Smiles: CC(C)[C@@H]1C=CC=C[C@]1(C#C)[C@H]2C=CC(=C[CH+]2)C#C
Highest priority first:

Priority: 7084

CC(C)[C@@H]1[CH:11]=[CH:10]C=C[C@]1(C#C)[C@H]2C=CC(=C[CH+:20]2)C#C>>CC(C)[C@@H]1[CH+:11][CH:10]2C=C[C@@]1([C@@H]3[CH:20]2C=C(C=C3)C#C)C#C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH:11]=[CH:10]C=C[C@]1(C#C)[C@H]2C=CC(=C[CH+:20]2)C#C>>CC(C)[C@@H]1[CH+:11][CH:10]2C=C[C@@]1([C@@H]3[CH:20]2C=C(C=C3)C#C)C#C 10,11=10,20

Priority: 7082

CC(C)[C@@H]1C=C[CH:10]=[CH:11][C@]1(C#C)[C@H]2C=CC(=C[CH+:20]2)C#C>>CC(C)[C@@H]1C=C[CH:10]2[CH+:11][C@@]1([C@@H]3[CH:20]2C=C(C=C3)C#C)C#C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C[CH:10]=[CH:11][C@]1(C#C)[C@H]2C=CC(=C[CH+:20]2)C#C>>CC(C)[C@@H]1C=C[CH:10]2[CH+:11][C@@]1([C@@H]3[CH:20]2C=C(C=C3)C#C)C#C 10,11=10,20

Priority: 7030

CC(C)[C@@H]1C=CC=C[C@]1(C#C)[C@H]2C=C[C:11](=[CH:10][CH+:20]2)C#C>>CC(C)[C@@H]1C=CC=C[C@]1(C#C)[C@H]2C=C[C+:11]([CH:10]=[CH:20]2)C#C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=CC=C[C@]1(C#C)[C@H]2C=C[C:11](=[CH:10][CH+:20]2)C#C>>CC(C)[C@@H]1C=CC=C[C@]1(C#C)[C@H]2C=C[C+:11]([CH:10]=[CH:20]2)C#C 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=CC=C2[C@]1(C=CC(=C2)C#N)[C@@H]3[CH+]C=Cc4c3ccc(c4)C#N
Highest priority first:

Priority: 7084

CC(C)[C@@H]1[CH:11]=[CH:10]C=C2[C@]1(C=CC(=C2)C#N)[C@@H]3[CH+:20]C=Cc4c3ccc(c4)C#N>>CC(C)[C@@H]1[CH+:11][CH:10]2C=C3[C@]1(C=CC(=C3)C#N)[C@@H]4[CH:20]2C=Cc5c4ccc(c5)C#N
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH:11]=[CH:10]C=C2[C@]1(C=CC(=C2)C#N)[C@@H]3[CH+:20]C=Cc4c3ccc(c4)C#N>>CC(C)[C@@H]1[CH+:11][CH:10]2C=C3[C@]1(C=CC(=C3)C#N)[C@@H]4[CH:20]2C=Cc5c4ccc(c5)C#N 10,11=10,20

Priority: 7082

CC(C)[C@@H]1C=CC=C2[C@]1([CH:11]=[CH:10]C(=C2)C#N)[C@@H]3[CH+:20]C=Cc4c3ccc(c4)C#N>>CC(C)[C@@H]1C=CC=C2[C@@]13[CH+:11][CH:10]([CH:20]4[C@@H]3c5ccc(cc5C=C4)C#N)C(=C2)C#N
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=CC=C2[C@]1([CH:11]=[CH:10]C(=C2)C#N)[C@@H]3[CH+:20]C=Cc4c3ccc(c4)C#N>>CC(C)[C@@H]1C=CC=C2[C@@]13[CH+:11][CH:10]([CH:20]4[C@@H]3c5ccc(cc5C=C4)C#N)C(=C2)C#N 10,11=10,20

Reagent: 140
Reactant Smiles: [1H]CC(=O)C[C@H](C=C)O.CC[O-]
Highest priority first:

Priority: 4377

[H:20][CH2:21][C:22](=[O:23])C[C@H](C=C)O.CC[O-:10]>>[H:20][O:10]CC.C=C[C@@H](C[C:22](=[CH2:21])[O-:23])O
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH2:21][C:22](=[O:23])C[C@H](C=C)O.CC[O-:10]>>[H:20][O:10]CC.C=C[C@@H](C[C:22](=[CH2:21])[O-:23])O 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][CH2:21]C(=O)C[C@H](C=C)O.CC[O-:10]>>[H:20][O:10]CC.[CH2-:21]C(=O)C[C@H](C=C)O
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH2:21]C(=O)C[C@H](C=C)O.CC[O-:10]>>[H:20][O:10]CC.[CH2-:21]C(=O)C[C@H](C=C)O 10=20;20,21=21

Reagent: 3
Reactant Smiles: [1H]OS(=O)(=O)O.CC[O@@H+]CC=C(O)O
Highest priority first:

Priority: 9005

[H:20][O:21]S(=O)(=O)O.CC[O@@H+]C[CH:10]=[C:11](O)[OH:12]>>[H:20][CH:10](C[O@H+]CC)[C:11](=[OH+:12])O.OS(=O)(=O)[O-:21]
( 1 pi 2 2; 4 sp3 None 2 10 sigma 11 2 )
n_O > π_C=C > σ^*_H-O [H:20][O:21]S(=O)(=O)O.CC[O@@H+]C[CH:10]=[C:11](O)[OH:12]>>[H:20][CH:10](C[O@H+]CC)[C:11](=[OH+:12])O.OS(=O)(=O)[O-:21] 10,11=10,20;12=11;20,21=21

Priority: 6850

[H:20][O:21]S(=O)(=O)O.CC[O@@H+]CC=C(O)[OH:10]>>[H:20][OH+:10]C(=CC[O@H+]CC)O.OS(=O)(=O)[O-:21]
( 8 sp3 None 2 6 sigma 20 2 )
n_O > σ^*_H-O [H:20][O:21]S(=O)(=O)O.CC[O@@H+]CC=C(O)[OH:10]>>[H:20][OH+:10]C(=CC[O@H+]CC)O.OS(=O)(=O)[O-:21] 10=20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1[C@@H](C2=CC=CC=C2N1)[C@H]3C=CC=C4[C+]3C=CN4
Highest priority first:

Priority: 2990

CC(C)[C@@H]1[C@@H](C2=CC=C[CH:10]=[C:11]2N1)[C@H]3C=CC=C4[C+:20]3C=CN4>>CC(C)[C@@H]1[C@@H]2[C@H]3C=CC=C4[C:20]3(C=CN4)[CH:10]5C=CC=C2[C+:11]5N1
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[C@@H](C2=CC=C[CH:10]=[C:11]2N1)[C@H]3C=CC=C4[C+:20]3C=CN4>>CC(C)[C@@H]1[C@@H]2[C@H]3C=CC=C4[C:20]3(C=CN4)[CH:10]5C=CC=C2[C+:11]5N1 10,11=10,20

Priority: 2985

CC(C)[C@@H]1[C@@H]([C:11]2=[CH:10]C=CC=C2N1)[C@H]3C=CC=C4[C+:20]3C=CN4>>CC(C)[C@@H]1[C@@H]2[C@H]3C=CC=C4[C:20]3(C=CN4)[CH:10]5[C+:11]2C(=CC=C5)N1
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[C@@H]([C:11]2=[CH:10]C=CC=C2N1)[C@H]3C=CC=C4[C+:20]3C=CN4>>CC(C)[C@@H]1[C@@H]2[C@H]3C=CC=C4[C:20]3(C=CN4)[CH:10]5[C+:11]2C(=CC=C5)N1 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=Cc2cccc(c2[CH+]1)Br.CC(C)[C@H]1C=CC2=C([CH+]1)C(=CC=C2)Br
Highest priority first:

Priority: 2600

CC(C)[C@H]1C=Cc2cccc(c2[CH+:20]1)Br.CC(C)[C@H]1C=CC2=C([CH+]1)[C:11](=[CH:10]C=C2)Br>>CC(C)[C@H]1C=CC2=C([CH+]1)[C+:11]([CH:10](C=C2)[CH:20]3c4c(cccc4Br)C=C[C@@H]3C(C)C)Br
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=Cc2cccc(c2[CH+:20]1)Br.CC(C)[C@H]1C=CC2=C([CH+]1)[C:11](=[CH:10]C=C2)Br>>CC(C)[C@H]1C=CC2=C([CH+]1)[C+:11]([CH:10](C=C2)[CH:20]3c4c(cccc4Br)C=C[C@@H]3C(C)C)Br 10,11=10,20

Priority: 2000

CC(C)[C@H]1C=Cc2cccc(c2[CH+:20]1)Br.CC(C)[C@H]1C=CC2=C([CH+]1)C(=C[CH:10]=[CH:11]2)Br>>CC(C)[C@H]1C=CC2=C([CH+]1)C(=C[CH:10]([CH+:11]2)[CH:20]3c4c(cccc4Br)C=C[C@@H]3C(C)C)Br
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=Cc2cccc(c2[CH+:20]1)Br.CC(C)[C@H]1C=CC2=C([CH+]1)C(=C[CH:10]=[CH:11]2)Br>>CC(C)[C@H]1C=CC2=C([CH+]1)C(=C[CH:10]([CH+:11]2)[CH:20]3c4c(cccc4Br)C=C[C@@H]3C(C)C)Br 10,11=10,20

Reagent: 3
Reactant Smiles: CC[C@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@@H]3C=CC=C([CH+]3)/C=C/C)/C=C/C.CC[C@@H]([C@@H]1C=CC=C([C@H]1[C@@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)C3=CC=CC=C3
Highest priority first:

Priority: 2500

CC[C@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@@H]3C=CC=C([CH+:20]3)/C=C/C)/C=C/C.CC[C@@H]([C@@H]1C=CC=C([C@H]1[C@@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)[C:13]3=[CH:12][CH:11]=[CH:10]C=C3>>CC[C@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@@H]3C=CC=C([CH:20]3[CH:10]4[CH:11]=[CH:12][C+:13](C=C4)[C@@H](CC)[C@@H]5C=CC=C([C@H]5[C@@H]6C=CC=C([CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC[C@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@@H]3C=CC=C([CH+:20]3)/C=C/C)/C=C/C.CC[C@@H]([C@@H]1C=CC=C([C@H]1[C@@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)[C:13]3=[CH:12][CH:11]=[CH:10]C=C3>>CC[C@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@@H]3C=CC=C([CH:20]3[CH:10]4[CH:11]=[CH:12][C+:13](C=C4)[C@@H](CC)[C@@H]5C=CC=C([C@H]5[C@@H]6C=CC=C([CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C 10,11=10,20;12,13=11,12

Priority: 2000

CC[C@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@@H]3C=CC=C([CH+:20]3)/C=C/C)/C=C/C.CC[C@@H]([C@@H]1C=CC=C([C@H]1[C@@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)C3=C[CH:10]=[CH:11]C=C3>>CC[C@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@@H]3C=CC=C([CH:20]3[CH:10]4C=C(C=C[CH+:11]4)[C@@H](CC)[C@@H]5C=CC=C([C@H]5[C@@H]6C=CC=C([CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC[C@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@@H]3C=CC=C([CH+:20]3)/C=C/C)/C=C/C.CC[C@@H]([C@@H]1C=CC=C([C@H]1[C@@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)C3=C[CH:10]=[CH:11]C=C3>>CC[C@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@@H]3C=CC=C([CH:20]3[CH:10]4C=C(C=C[CH+:11]4)[C@@H](CC)[C@@H]5C=CC=C([C@H]5[C@@H]6C=CC=C([CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C 10,11=10,20

Reagent: 87
Reactant Smiles: [1H]C(c1ccccc1)C(=O)CC(=O)C[C@](C)(CC(=O)Cc2ccccc2)[O-].[OH-]
Highest priority first:

Priority: 4381

[H:20][CH:21](c1ccccc1)[C:22](=[O:23])CC(=O)C[C@](C)(CC(=O)Cc2ccccc2)[O-].[OH-:10]>>[H:20][OH:10].C[C@](CC(=O)Cc1ccccc1)(CC(=O)C[C:22](=[CH:21]c2ccccc2)[O-:23])[O-]
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH:21](c1ccccc1)[C:22](=[O:23])CC(=O)C[C@](C)(CC(=O)Cc2ccccc2)[O-].[OH-:10]>>[H:20][OH:10].C[C@](CC(=O)Cc1ccccc1)(CC(=O)C[C:22](=[CH:21]c2ccccc2)[O-:23])[O-] 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][CH:21](c1ccccc1)C(=O)CC(=O)C[C@](C)(CC(=O)Cc2ccccc2)[O-].[OH-:10]>>[H:20][OH:10].C[C@](CC(=O)Cc1ccccc1)(CC(=O)CC(=O)[CH-:21]c2ccccc2)[O-]
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH:21](c1ccccc1)C(=O)CC(=O)C[C@](C)(CC(=O)Cc2ccccc2)[O-].[OH-:10]>>[H:20][OH:10].C[C@](CC(=O)Cc1ccccc1)(CC(=O)CC(=O)[CH-:21]c2ccccc2)[O-] 10=20;20,21=21

Reagent: 3
Reactant Smiles: COC[C@H]1[C@H]2C=C(C=C[C@H]2[C@@H]3[C+]1C=CC=C3)/C=C/OC
Highest priority first:

Priority: 7084

COC[C@H]1[C@H]2C=C([CH:10]=[CH:11][C@H]2[C@@H]3[C+:20]1C=CC=C3)/C=C/OC>>COC[C@H]1[C@H]2C=C([CH:10]3[C:20]14C=CC=C[C@@H]4[C@@H]2[CH+:11]3)/C=C/OC
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C COC[C@H]1[C@H]2C=C([CH:10]=[CH:11][C@H]2[C@@H]3[C+:20]1C=CC=C3)/C=C/OC>>COC[C@H]1[C@H]2C=C([CH:10]3[C:20]14C=CC=C[C@@H]4[C@@H]2[CH+:11]3)/C=C/OC 10,11=10,20

Priority: 7030

COC[C@H]1[C@H]2C=C(C=C[C@H]2[C@@H]3[C+:20]1[CH:10]=[CH:11]C=C3)/C=C/OC>>COC[C@H]1[C@H]2C=C(C=C[C@H]2[C@@H]3[C:20]1=[CH:10][CH+:11]C=C3)/C=C/OC
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C COC[C@H]1[C@H]2C=C(C=C[C@H]2[C@@H]3[C+:20]1[CH:10]=[CH:11]C=C3)/C=C/OC>>COC[C@H]1[C@H]2C=C(C=C[C@H]2[C@@H]3[C:20]1=[CH:10][CH+:11]C=C3)/C=C/OC 10,11=10,20

Reagent: 87
Reactant Smiles: [1H]CC(=O)C[C@@]1([C@H](C(=O)C[C@](O1)(C)O)c2ccccc2)Cc3ccccc3.[OH-]
Highest priority first:

Priority: 4386

[H:20][CH2:21][C:22](=[O:23])C[C@@]1([C@H](C(=O)C[C@](O1)(C)O)c2ccccc2)Cc3ccccc3.[OH-:10]>>[H:20][OH:10].C[C@@]1(CC(=O)[C@@H]([C@@](O1)(Cc2ccccc2)C[C:22](=[CH2:21])[O-:23])c3ccccc3)O
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH2:21][C:22](=[O:23])C[C@@]1([C@H](C(=O)C[C@](O1)(C)O)c2ccccc2)Cc3ccccc3.[OH-:10]>>[H:20][OH:10].C[C@@]1(CC(=O)[C@@H]([C@@](O1)(Cc2ccccc2)C[C:22](=[CH2:21])[O-:23])c3ccccc3)O 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][CH2:21]C(=O)C[C@@]1([C@H](C(=O)C[C@](O1)(C)O)c2ccccc2)Cc3ccccc3.[OH-:10]>>[H:20][OH:10].C[C@@]1(CC(=O)[C@@H]([C@@](O1)(Cc2ccccc2)CC(=O)[CH2-:21])c3ccccc3)O
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH2:21]C(=O)C[C@@]1([C@H](C(=O)C[C@](O1)(C)O)c2ccccc2)Cc3ccccc3.[OH-:10]>>[H:20][OH:10].C[C@@]1(CC(=O)[C@@H]([C@@](O1)(Cc2ccccc2)CC(=O)[CH2-:21])c3ccccc3)O 10=20;20,21=21

Reagent: 3
Reactant Smiles: CC(C)[C@@H](c1ccccc1)C2C=CC(C=C2)(C=C(C)C)[C@H]3C=CC=C([CH+]3)C=C(C)C.CC(=CC1=CC=CC=C1)C
Highest priority first:

Priority: 2500

CC(C)[C@@H](c1ccccc1)C2C=CC(C=C2)(C=C(C)C)[C@H]3C=CC=C([CH+:20]3)C=C(C)C.CC(=C[C:11]1=[CH:10]C=CC=C1)C>>CC(C)[C@@H](c1ccccc1)C2C=CC(C=C2)(C=C(C)C)[C@H]3C=CC=C([CH:20]3[CH:10]4C=CC=C[C+:11]4C=C(C)C)C=C(C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H](c1ccccc1)C2C=CC(C=C2)(C=C(C)C)[C@H]3C=CC=C([CH+:20]3)C=C(C)C.CC(=C[C:11]1=[CH:10]C=CC=C1)C>>CC(C)[C@@H](c1ccccc1)C2C=CC(C=C2)(C=C(C)C)[C@H]3C=CC=C([CH:20]3[CH:10]4C=CC=C[C+:11]4C=C(C)C)C=C(C)C 10,11=10,20

Priority: 2000

CC(C)[C@@H](c1ccccc1)C2C=CC(C=C2)(C=C(C)C)[C@H]3C=CC=C([CH+:20]3)C=C(C)C.CC(=CC1=C[CH:10]=[CH:11]C=C1)C>>CC(C)[C@@H](c1ccccc1)C2C=CC(C=C2)(C=C(C)C)[C@H]3C=CC=C([CH:20]3[CH:10]4C=C(C=C[CH+:11]4)C=C(C)C)C=C(C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H](c1ccccc1)C2C=CC(C=C2)(C=C(C)C)[C@H]3C=CC=C([CH+:20]3)C=C(C)C.CC(=CC1=C[CH:10]=[CH:11]C=C1)C>>CC(C)[C@@H](c1ccccc1)C2C=CC(C=C2)(C=C(C)C)[C@H]3C=CC=C([CH:20]3[CH:10]4C=C(C=C[CH+:11]4)C=C(C)C)C=C(C)C 10,11=10,20

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@H]2C=CC=C[C+]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4O.[Cl-]
Highest priority first:

Priority: 2955

c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@H]2C=CC=C[C+]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@H]3C=CC=C[C+]3/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CC=C[C+]5O.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@H]2C=CC=C[C+]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@H]3C=CC=C[C+]3/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CC=C[C+]5O.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@H]2C=CC=C[C+]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@H]3C=CC=C[C+]3/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CC=C[C+]5O.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@H]2C=CC=C[C+]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@H]3C=CC=C[C+]3/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CC=C[C+]5O.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@H]2C=CC=C[C+]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@H]3C=CC=C[C+]3/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CC=C[C+]5O.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@H]2C=CC=C[C+]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@H]3C=CC=C[C+]3/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CC=C[C+]5O.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@H]2C=CC=C[C+]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@H]3C=CC=C[C+]3/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CC=C[C+]5O.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@H]2C=CC=C[C+]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@H]3C=CC=C[C+]3/N=N/[C@@H]4C=C(C=C[CH+]4)/N=N/[C@@H]5C=CC=C[C+]5O.[Cl-] 10,11=10,20;20,21=21

Reagent: 3
Reactant Smiles: CC(C)[C@H]1C=CC=C([C@H]1[C@@H]2C=CC(=C[CH+]2)N)[NH3+]
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[CH:10]C=C([C@H]1[C@@H]2C=CC(=C[CH+:20]2)N)[NH3+]>>CC(C)[C@H]1[CH+:11][CH:10]2C=C([C@H]1[C@H]3[CH:20]2C=C(C=C3)N)[NH3+]
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[CH:10]C=C([C@H]1[C@@H]2C=CC(=C[CH+:20]2)N)[NH3+]>>CC(C)[C@H]1[CH+:11][CH:10]2C=C([C@H]1[C@H]3[CH:20]2C=C(C=C3)N)[NH3+] 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=C[CH:10]=[C:11]([C@H]1[C@@H]2C=CC(=C[CH+:20]2)N)[NH3+]>>CC(C)[C@H]1C=C[CH:10]2[CH:20]3C=C(C=C[C@H]3[C@@H]1[C+:11]2[NH3+])N
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=C[CH:10]=[C:11]([C@H]1[C@@H]2C=CC(=C[CH+:20]2)N)[NH3+]>>CC(C)[C@H]1C=C[CH:10]2[CH:20]3C=C(C=C[C@H]3[C@@H]1[C+:11]2[NH3+])N 10,11=10,20

Priority: 7030

CC(C)[C@H]1C=CC=C([C@H]1[C@@H]2C=C[C:11](=[CH:10][CH+:20]2)N)[NH3+]>>CC(C)[C@H]1C=CC=C([C@H]1[C@@H]2C=C[C+:11]([CH:10]=[CH:20]2)N)[NH3+]
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC=C([C@H]1[C@@H]2C=C[C:11](=[CH:10][CH+:20]2)N)[NH3+]>>CC(C)[C@H]1C=CC=C([C@H]1[C@@H]2C=C[C+:11]([CH:10]=[CH:20]2)N)[NH3+] 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH+]C=C(O2)C(=O)C)C(=O)C.CC(=O)C1=CC=CO1
Highest priority first:

Priority: 2925

CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH+:20]C=C(O2)C(=O)C)C(=O)C.CC(=O)C1=C[CH:11]=[CH:10]O1>>CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH:20](C=C(O2)C(=O)C)[CH:10]3[CH+:11]C=C(O3)C(=O)C)C(=O)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH+:20]C=C(O2)C(=O)C)C(=O)C.CC(=O)C1=C[CH:11]=[CH:10]O1>>CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH:20](C=C(O2)C(=O)C)[CH:10]3[CH+:11]C=C(O3)C(=O)C)C(=O)C 10,11=10,20

Priority: 2920

CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH+:20]C=C(O2)C(=O)C)C(=O)C.CC(=O)[C:11]1=[CH:10]C=CO1>>CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH:20](C=C(O2)C(=O)C)[CH:10]3C=CO[C+:11]3C(=O)C)C(=O)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH+:20]C=C(O2)C(=O)C)C(=O)C.CC(=O)[C:11]1=[CH:10]C=CO1>>CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH:20](C=C(O2)C(=O)C)[CH:10]3C=CO[C+:11]3C(=O)C)C(=O)C 10,11=10,20

Priority: 2741

CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH+:20]C=C(O2)C(=O)C)C(=O)C.CC(=O)C1=[CH:11][CH:10]=CO1>>CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH:20](C=C(O2)C(=O)C)[CH:10]=COC(=[CH+:11])C(=O)C)C(=O)C
( 3 sigma 2 2 5 p None 0 )
σ_C-C > p_C CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH+:20]C=C(O2)C(=O)C)C(=O)C.CC(=O)C1=[CH:11][CH:10]=CO1>>CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH:20](C=C(O2)C(=O)C)[CH:10]=COC(=[CH+:11])C(=O)C)C(=O)C 10,11=10,20

Priority: 2500

CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH+:20]C=C(O2)C(=O)C)C(=O)C.CC(=O)[C:13]1=[CH:12][CH:11]=[CH:10]O1>>CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH:20](C=C(O2)C(=O)C)[CH:10]3[CH:11]=[CH:12][C+:13](O3)C(=O)C)C(=O)C
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH+:20]C=C(O2)C(=O)C)C(=O)C.CC(=O)[C:13]1=[CH:12][CH:11]=[CH:10]O1>>CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH:20](C=C(O2)C(=O)C)[CH:10]3[CH:11]=[CH:12][C+:13](O3)C(=O)C)C(=O)C 10,11=10,20;12,13=11,12

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH+]3)cccc2C(=O)C.CC(=O)C1=CC=Cc2c1cccc2
Highest priority first:

Priority: 2550

CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH+:20]3)cccc2C(=O)C.CC(=O)[C:13]1=[CH:12][CH:11]=[CH:10]c2c1cccc2>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH:20]3[CH:10]5[CH:11]=[CH:12][C+:13](c6c5cccc6)C(=O)C)cccc2C(=O)C
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH+:20]3)cccc2C(=O)C.CC(=O)[C:13]1=[CH:12][CH:11]=[CH:10]c2c1cccc2>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH:20]3[CH:10]5[CH:11]=[CH:12][C+:13](c6c5cccc6)C(=O)C)cccc2C(=O)C 10,11=10,20;12,13=11,12

Priority: 2500

CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH+:20]3)cccc2C(=O)C.CC(=O)[C:11]1=[CH:10]C=Cc2c1cccc2>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH:20]3[CH:10]5C=Cc6ccccc6[C+:11]5C(=O)C)cccc2C(=O)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH+:20]3)cccc2C(=O)C.CC(=O)[C:11]1=[CH:10]C=Cc2c1cccc2>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH:20]3[CH:10]5C=Cc6ccccc6[C+:11]5C(=O)C)cccc2C(=O)C 10,11=10,20

Priority: 2000

CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH+:20]3)cccc2C(=O)C.CC(=O)C1=C[CH:10]=[CH:11]c2c1cccc2>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH:20]3[CH:10]5C=C(c6ccccc6[CH+:11]5)C(=O)C)cccc2C(=O)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH+:20]3)cccc2C(=O)C.CC(=O)C1=C[CH:10]=[CH:11]c2c1cccc2>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH:20]3[CH:10]5C=C(c6ccccc6[CH+:11]5)C(=O)C)cccc2C(=O)C 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=CC=C2[C@@]1(C=CC=C2C#N)[C@H]3C=C(c4ccccc4[CH+]3)C#N
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[CH:10]C=C2[C@@]1(C=CC=C2C#N)[C@H]3C=C(c4ccccc4[CH+:20]3)C#N>>CC(C)[C@H]1[CH+:11][CH:10]2C=C3[C@@]1(C=CC=C3C#N)[C@@H]4[CH:20]2c5ccccc5C(=C4)C#N
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[CH:10]C=C2[C@@]1(C=CC=C2C#N)[C@H]3C=C(c4ccccc4[CH+:20]3)C#N>>CC(C)[C@H]1[CH+:11][CH:10]2C=C3[C@@]1(C=CC=C3C#N)[C@@H]4[CH:20]2c5ccccc5C(=C4)C#N 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=CC=C2[C@@]1([CH:11]=[CH:10]C=C2C#N)[C@H]3C=C(c4ccccc4[CH+:20]3)C#N>>CC(C)[C@H]1C=CC=C2[C@]13[CH+:11][CH:10](C=C2C#N)[CH:20]4[C@@H]3C=C(c5c4cccc5)C#N
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC=C2[C@@]1([CH:11]=[CH:10]C=C2C#N)[C@H]3C=C(c4ccccc4[CH+:20]3)C#N>>CC(C)[C@H]1C=CC=C2[C@]13[CH+:11][CH:10](C=C2C#N)[CH:20]4[C@@H]3C=C(c5c4cccc5)C#N 10,11=10,20

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1C=C[C@H]([CH+]C1=O)/N=N/C2=CC=CC=C2.[Cl-]
Highest priority first:

Priority: 2955

c1ccc(cc1)[N+:21]#[N:20].C1C=C[C@H]([CH+]C1=O)/N=N/[C:13]2=[CH:12][CH:11]=[CH:10]C=C2.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=CCC(=O)[CH+]3.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1C=C[C@H]([CH+]C1=O)/N=N/[C:13]2=[CH:12][CH:11]=[CH:10]C=C2.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=CCC(=O)[CH+]3.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

c1ccc(cc1)[N+:21]#[N:20].C1C=C[C@H]([CH+]C1=O)/N=N/[C:11]2=[CH:10]C=CC=C2.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=CCC(=O)[CH+]3.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1C=C[C@H]([CH+]C1=O)/N=N/[C:11]2=[CH:10]C=CC=C2.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=CCC(=O)[CH+]3.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

c1ccc(cc1)[N+:21]#[N:20].C1C=C[C@H]([CH+]C1=O)/N=N/C2=CC=C[CH:10]=[CH:11]2.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CCC(=O)[CH+]3.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1C=C[C@H]([CH+]C1=O)/N=N/C2=CC=C[CH:10]=[CH:11]2.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CCC(=O)[CH+]3.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

c1ccc(cc1)[N+:21]#[N:20].C1C=C[C@H]([CH+]C1=O)/N=N/C2=CC=C[CH:10]=[CH:11]2.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CCC(=O)[CH+]3.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1C=C[C@H]([CH+]C1=O)/N=N/C2=CC=C[CH:10]=[CH:11]2.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CCC(=O)[CH+]3.[Cl-] 10,11=10,20;20,21=21

Reagent: 87
Reactant Smiles: CCOC(=O)C=C.CCOC(=O)[C-](C(=O)C=C)C(=O)OCC
Highest priority first:

Priority: 4472

CCO[C:22](=[O:23])[CH:21]=[CH2:20].CCOC(=O)[C-:10](C(=O)C=C)C(=O)OCC>>CCO[C:22](=[CH:21][CH2:20][C:10](C(=O)C=C)(C(=O)OCC)C(=O)OCC)[O-:23]
( 7 sp3 None 2 4 pi 3 2; 1 pi 2 2 )
n_C > π^*_C=C > π^*_C=O CCO[C:22](=[O:23])[CH:21]=[CH2:20].CCOC(=O)[C-:10](C(=O)C=C)C(=O)OCC>>CCO[C:22](=[CH:21][CH2:20][C:10](C(=O)C=C)(C(=O)OCC)C(=O)OCC)[O-:23] 10=20;20,21=21,22;22,23=23

Priority: 4404

CCO[C:20](=[O:21])C=C.CCOC(=O)[C-:10](C(=O)C=C)C(=O)OCC>>CCOC(=O)[C:10](C(=O)C=C)(C(=O)OCC)[C:20](C=C)([O-:21])OCC
( 7 sp3 None 2 1 pi 2 2 )
n_C > π^*_C=O CCO[C:20](=[O:21])C=C.CCOC(=O)[C-:10](C(=O)C=C)C(=O)OCC>>CCOC(=O)[C:10](C(=O)C=C)(C(=O)OCC)[C:20](C=C)([O-:21])OCC 10=20;20,21=21

Reagent: 3
Reactant Smiles: CC(C)[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@H]3C=CC(=C[CH+]3)C=C(C)C)C=C(C)C
Highest priority first:

Priority: 7084

CC(C)[C@H](c1ccccc1)[C@H]2[CH:11]=[CH:10]C(=C[C@@H]2[C@H]3C=CC(=C[CH+:20]3)C=C(C)C)C=C(C)C>>CC(C)[C@H](c1ccccc1)[C@H]2[CH+:11][CH:10]3[CH:20]4C=C(C=C[C@@H]4[C@H]2C=C3C=C(C)C)C=C(C)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H](c1ccccc1)[C@H]2[CH:11]=[CH:10]C(=C[C@@H]2[C@H]3C=CC(=C[CH+:20]3)C=C(C)C)C=C(C)C>>CC(C)[C@H](c1ccccc1)[C@H]2[CH+:11][CH:10]3[CH:20]4C=C(C=C[C@@H]4[C@H]2C=C3C=C(C)C)C=C(C)C 10,11=10,20

Priority: 7082

CC(C)[C@H](c1ccccc1)[C@H]2C=C[C:10](=[CH:11][C@@H]2[C@H]3C=CC(=C[CH+:20]3)C=C(C)C)C=C(C)C>>CC(C)[C@H](c1ccccc1)[C@H]2C=C[C:10]3([CH+:11][C@@H]2[C@@H]4[CH:20]3C=C(C=C4)C=C(C)C)C=C(C)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H](c1ccccc1)[C@H]2C=C[C:10](=[CH:11][C@@H]2[C@H]3C=CC(=C[CH+:20]3)C=C(C)C)C=C(C)C>>CC(C)[C@H](c1ccccc1)[C@H]2C=C[C:10]3([CH+:11][C@@H]2[C@@H]4[CH:20]3C=C(C=C4)C=C(C)C)C=C(C)C 10,11=10,20

Priority: 7030

CC(C)[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@H]3C=C[C:11](=[CH:10][CH+:20]3)C=C(C)C)C=C(C)C>>CC(C)[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@H]3C=C[C+:11]([CH:10]=[CH:20]3)C=C(C)C)C=C(C)C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@H]3C=C[C:11](=[CH:10][CH+:20]3)C=C(C)C)C=C(C)C>>CC(C)[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@H]3C=C[C+:11]([CH:10]=[CH:20]3)C=C(C)C)C=C(C)C 10,11=10,20

Reagent: 24
Reactant Smiles: CO[C+]1C=C[C@H](C2=CC=CC=C21)Br.[Fe-](Br)(Br)(Br)[Br+]Br
Highest priority first:

Priority: 2500

CO[C+]1C=C[C@H](C2=CC=C[CH:10]=[C:11]21)Br.[Fe-](Br)(Br)(Br)[Br+:21][Br:20]>>CO[C+]1C=C[C@H](C2=CC=C[CH:10]([C+:11]21)[Br:20])Br.[Fe-](Br)(Br)(Br)[Br:21]
( 2 pi 1 2 5 sigma 6 2 )
π_C=C > σ^*_Br-Br CO[C+]1C=C[C@H](C2=CC=C[CH:10]=[C:11]21)Br.[Fe-](Br)(Br)(Br)[Br+:21][Br:20]>>CO[C+]1C=C[C@H](C2=CC=C[CH:10]([C+:11]21)[Br:20])Br.[Fe-](Br)(Br)(Br)[Br:21] 10,11=10,20;20,21=21

Priority: 2000

CO[C+]1C=C[C@H](C2=C[CH:11]=[CH:10]C=C21)Br.[Fe-](Br)(Br)(Br)[Br+:21][Br:20]>>CO[C+]1C=C[C@H](C2=C[CH+:11][CH:10](C=C21)[Br:20])Br.[Fe-](Br)(Br)(Br)[Br:21]
( 2 pi 1 2 5 sigma 6 2 )
π_C=C > σ^*_Br-Br CO[C+]1C=C[C@H](C2=C[CH:11]=[CH:10]C=C21)Br.[Fe-](Br)(Br)(Br)[Br+:21][Br:20]>>CO[C+]1C=C[C@H](C2=C[CH+:11][CH:10](C=C21)[Br:20])Br.[Fe-](Br)(Br)(Br)[Br:21] 10,11=10,20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2cc[nH]c2=C[C@@H]1[C@@H]3C=Cc4cc[nH]c4[CH+]3.c1ccc2c(c1)C=CN2
Highest priority first:

Priority: 2925

CC(C)[C@@H]1C=c2cc[nH]c2=C[C@@H]1[C@@H]3C=Cc4cc[nH]c4[CH+:20]3.c1ccc2c(c1)[CH:11]=[CH:10]N2>>CC(C)[C@@H]1C=c2cc[nH]c2=C[C@@H]1[C@@H]3C=Cc4cc[nH]c4[CH:20]3[CH:10]5[CH+:11]c6ccccc6N5
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2cc[nH]c2=C[C@@H]1[C@@H]3C=Cc4cc[nH]c4[CH+:20]3.c1ccc2c(c1)[CH:11]=[CH:10]N2>>CC(C)[C@@H]1C=c2cc[nH]c2=C[C@@H]1[C@@H]3C=Cc4cc[nH]c4[CH:20]3[CH:10]5[CH+:11]c6ccccc6N5 10,11=10,20

Priority: 2920

CC(C)[C@@H]1C=c2cc[nH]c2=C[C@@H]1[C@@H]3C=Cc4cc[nH]c4[CH+:20]3.c1ccc2c(c1)[CH:10]=[CH:11]N2>>CC(C)[C@@H]1C=c2cc[nH]c2=C[C@@H]1[C@@H]3C=Cc4cc[nH]c4[CH:20]3[CH:10]5[CH+:11]Nc6c5cccc6
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2cc[nH]c2=C[C@@H]1[C@@H]3C=Cc4cc[nH]c4[CH+:20]3.c1ccc2c(c1)[CH:10]=[CH:11]N2>>CC(C)[C@@H]1C=c2cc[nH]c2=C[C@@H]1[C@@H]3C=Cc4cc[nH]c4[CH:20]3[CH:10]5[CH+:11]Nc6c5cccc6 10,11=10,20

Reagent: 140
Reactant Smiles: CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCCCBr)C(=O)[CH2-])O.CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCCCBr)C(=O)[CH2-])O
Highest priority first:

Priority: 4550

CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCCCBr)C(=O)[CH2-:10])O.CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCC[CH2:20][Br:21])C(=O)[CH2-])O>>CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCC[CH2:20][CH2:10]C(=O)[C@@H](CCCCBr)[C@@](C)(CC(=O)[C@@H](CCCCBr)C(=O)C)O)C(=O)[CH2-])O.[Br-:21]
( 1 sp3 None 2 4 sigma 5 2 )
n_C > σ^*_C-Br CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCCCBr)C(=O)[CH2-:10])O.CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCC[CH2:20][Br:21])C(=O)[CH2-])O>>CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCC[CH2:20][CH2:10]C(=O)[C@@H](CCCCBr)[C@@](C)(CC(=O)[C@@H](CCCCBr)C(=O)C)O)C(=O)[CH2-])O.[Br-:21] 10=20;20,21=21

Priority: 4402

CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCCCBr)C(=O)[CH2-:10])O.CC(=O)[C@H](CCCCBr)[C:20](=[O:21])C[C@](C)([C@H](CCCCBr)C(=O)[CH2-])O>>CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCCCBr)C(=O)[CH2:10][C:20](C[C@](C)([C@H](CCCCBr)C(=O)[CH2-])O)([C@@H](CCCCBr)C(=O)C)[O-:21])O
( 7 sp3 None 2 1 pi 2 2 )
n_C > π^*_C=O CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCCCBr)C(=O)[CH2-:10])O.CC(=O)[C@H](CCCCBr)[C:20](=[O:21])C[C@](C)([C@H](CCCCBr)C(=O)[CH2-])O>>CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCCCBr)C(=O)[CH2:10][C:20](C[C@](C)([C@H](CCCCBr)C(=O)[CH2-])O)([C@@H](CCCCBr)C(=O)C)[O-:21])O 10=20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+]3)C#N)C#N.c1ccc2c(c1)C=CC=C2C#N
Highest priority first:

Priority: 2550

CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+:20]3)C#N)C#N.c1ccc2c(c1)[CH:10]=[CH:11][CH:12]=[C:13]2C#N>>CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH:20]3[CH:10]5[CH:11]=[CH:12][C+:13](c6c5cccc6)C#N)C#N)C#N
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+:20]3)C#N)C#N.c1ccc2c(c1)[CH:10]=[CH:11][CH:12]=[C:13]2C#N>>CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH:20]3[CH:10]5[CH:11]=[CH:12][C+:13](c6c5cccc6)C#N)C#N)C#N 10,11=10,20;12,13=11,12

Priority: 2500

CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+:20]3)C#N)C#N.c1ccc2c(c1)C=C[CH:10]=[C:11]2C#N>>CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH:20]3[CH:10]5C=Cc6ccccc6[C+:11]5C#N)C#N)C#N
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+:20]3)C#N)C#N.c1ccc2c(c1)C=C[CH:10]=[C:11]2C#N>>CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH:20]3[CH:10]5C=Cc6ccccc6[C+:11]5C#N)C#N)C#N 10,11=10,20

Priority: 2000

CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+:20]3)C#N)C#N.c1ccc2c(c1)[CH:11]=[CH:10]C=C2C#N>>CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH:20]3[CH:10]5C=C(c6ccccc6[CH+:11]5)C#N)C#N)C#N
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+:20]3)C#N)C#N.c1ccc2c(c1)[CH:11]=[CH:10]C=C2C#N>>CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH:20]3[CH:10]5C=C(c6ccccc6[CH+:11]5)C#N)C#N)C#N 10,11=10,20

Reagent: 3
Reactant Smiles: CC[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH+]3)/C=C/C)/C=C/C.CC[C@H]([C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH+]2)/C=C/C)/C=C/C)C3=CC=CC=C3
Highest priority first:

Priority: 2500

CC[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH+:20]3)/C=C/C)/C=C/C.CC[C@H]([C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH+]2)/C=C/C)/C=C/C)[C:13]3=[CH:12][CH:11]=[CH:10]C=C3>>CC[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH:20]3[CH:10]4[CH:11]=[CH:12][C+:13](C=C4)[C@H](CC)[C@@H]5C=CC=C([C@@H]5[C@@H]6C=CC(=C[CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH+:20]3)/C=C/C)/C=C/C.CC[C@H]([C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH+]2)/C=C/C)/C=C/C)[C:13]3=[CH:12][CH:11]=[CH:10]C=C3>>CC[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH:20]3[CH:10]4[CH:11]=[CH:12][C+:13](C=C4)[C@H](CC)[C@@H]5C=CC=C([C@@H]5[C@@H]6C=CC(=C[CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C 10,11=10,20;12,13=11,12

Priority: 2000

CC[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH+:20]3)/C=C/C)/C=C/C.CC[C@H]([C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH+]2)/C=C/C)/C=C/C)C3=C[CH:10]=[CH:11]C=C3>>CC[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)[C@H](CC)[C@@H]5C=CC=C([C@@H]5[C@@H]6C=CC(=C[CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH+:20]3)/C=C/C)/C=C/C.CC[C@H]([C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH+]2)/C=C/C)/C=C/C)C3=C[CH:10]=[CH:11]C=C3>>CC[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)[C@H](CC)[C@@H]5C=CC=C([C@@H]5[C@@H]6C=CC(=C[CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C 10,11=10,20

Reagent: 66
Reactant Smiles: CC1=CC=C[C+]2C1=CC=C[C@H]2[C@@]3([C@H](C=CC4=CC=CC=C43)C(C)C)C
Highest priority first:

Priority: 2985

CC1=CC=C[C+:20]2C1=CC=C[C@H]2[C@@]3([C@H](C=CC4=CC=C[CH:10]=[C:11]43)C(C)C)C>>CC1=CC=C[C:20]23C1=CC=C[C@H]2[C@@]4([C@H](C=CC5=CC=C[CH:10]3[C+:11]54)C(C)C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC1=CC=C[C+:20]2C1=CC=C[C@H]2[C@@]3([C@H](C=CC4=CC=C[CH:10]=[C:11]43)C(C)C)C>>CC1=CC=C[C:20]23C1=CC=C[C@H]2[C@@]4([C@H](C=CC5=CC=C[CH:10]3[C+:11]54)C(C)C)C 10,11=10,20

Priority: 2980

CC1=CC=C[C+:20]2C1=CC=C[C@H]2[C@@]3([C@H](C=C[C:11]4=[CH:10]C=CC=C43)C(C)C)C>>CC1=CC=C[C:20]23C1=CC=C[C@H]2[C@@]4([C@H](C=C[C+:11]5[CH:10]3C=CC=C54)C(C)C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC1=CC=C[C+:20]2C1=CC=C[C@H]2[C@@]3([C@H](C=C[C:11]4=[CH:10]C=CC=C43)C(C)C)C>>CC1=CC=C[C:20]23C1=CC=C[C@H]2[C@@]4([C@H](C=C[C+:11]5[CH:10]3C=CC=C54)C(C)C)C 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+]3)C(=O)C)C(=O)C.CC(=O)C1=CC=Cc2c1cccc2
Highest priority first:

Priority: 2550

CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+:20]3)C(=O)C)C(=O)C.CC(=O)[C:13]1=[CH:12][CH:11]=[CH:10]c2c1cccc2>>CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH:20]3[CH:10]5[CH:11]=[CH:12][C+:13](c6c5cccc6)C(=O)C)C(=O)C)C(=O)C
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+:20]3)C(=O)C)C(=O)C.CC(=O)[C:13]1=[CH:12][CH:11]=[CH:10]c2c1cccc2>>CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH:20]3[CH:10]5[CH:11]=[CH:12][C+:13](c6c5cccc6)C(=O)C)C(=O)C)C(=O)C 10,11=10,20;12,13=11,12

Priority: 2500

CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+:20]3)C(=O)C)C(=O)C.CC(=O)[C:11]1=[CH:10]C=Cc2c1cccc2>>CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH:20]3[CH:10]5C=Cc6ccccc6[C+:11]5C(=O)C)C(=O)C)C(=O)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+:20]3)C(=O)C)C(=O)C.CC(=O)[C:11]1=[CH:10]C=Cc2c1cccc2>>CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH:20]3[CH:10]5C=Cc6ccccc6[C+:11]5C(=O)C)C(=O)C)C(=O)C 10,11=10,20

Priority: 2000

CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+:20]3)C(=O)C)C(=O)C.CC(=O)C1=C[CH:10]=[CH:11]c2c1cccc2>>CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH:20]3[CH:10]5C=C(c6ccccc6[CH+:11]5)C(=O)C)C(=O)C)C(=O)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+:20]3)C(=O)C)C(=O)C.CC(=O)C1=C[CH:10]=[CH:11]c2c1cccc2>>CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH:20]3[CH:10]5C=C(c6ccccc6[CH+:11]5)C(=O)C)C(=O)C)C(=O)C 10,11=10,20

Reagent: 27
Reactant Smiles: CC[OH+][C+]([C@@](Cc1ccccc1)([C@]([OH2+])(O)OCC)NC(=O)C)O
Highest priority first:

Priority: 6973

CC[OH+][C+]([C@@](Cc1ccccc1)([C@:20]([OH2+:21])([OH:10])OCC)NC(=O)C)O>>CC[OH+][C+]([C@@](Cc1ccccc1)([C@:20](=[OH+:10])OCC)NC(=O)C)O.[OH2:21]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-O CC[OH+][C+]([C@@](Cc1ccccc1)([C@:20]([OH2+:21])([OH:10])OCC)NC(=O)C)O>>CC[OH+][C+]([C@@](Cc1ccccc1)([C@:20](=[OH+:10])OCC)NC(=O)C)O.[OH2:21] 10=20;20,21=21

Priority: 6970

CC[OH+][C+]([C@@](Cc1ccccc1)([C@:20]([OH2+:21])(O)[O:10]CC)NC(=O)C)O>>CC[OH+][C+]([C@@](Cc1ccccc1)([C@@:20](=[O+:10]CC)O)NC(=O)C)O.[OH2:21]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-O CC[OH+][C+]([C@@](Cc1ccccc1)([C@:20]([OH2+:21])(O)[O:10]CC)NC(=O)C)O>>CC[OH+][C+]([C@@](Cc1ccccc1)([C@@:20](=[O+:10]CC)O)NC(=O)C)O.[OH2:21] 10=20;20,21=21

Priority: 4100

CC[OH+][C+]([C@@](Cc1ccccc1)([C@:20]([OH2+:21])(O)OCC)NC(=O)C)O>>CC[OH+][C+]([C@@](Cc1ccccc1)([C@+:20](O)OCC)NC(=O)C)O.[OH2:21]
( 1 sigma 2 2 1 sigma 2 2 )
σ_C-O > σ^*_C-O CC[OH+][C+]([C@@](Cc1ccccc1)([C@:20]([OH2+:21])(O)OCC)NC(=O)C)O>>CC[OH+][C+]([C@@](Cc1ccccc1)([C@+:20](O)OCC)NC(=O)C)O.[OH2:21] 20,21=21

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4[CH]S[CH][CH+]4.[Cl-]
Highest priority first:

Priority: 2955

c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4[CH]S[CH][CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@@H]5[CH]S[CH][CH+]5.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4[CH]S[CH][CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@@H]5[CH]S[CH][CH+]5.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4[CH]S[CH][CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@@H]5[CH]S[CH][CH+]5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4[CH]S[CH][CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@@H]5[CH]S[CH][CH+]5.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4[CH]S[CH][CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@@H]5[CH]S[CH][CH+]5.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4[CH]S[CH][CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@@H]5[CH]S[CH][CH+]5.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4[CH]S[CH][CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@@H]5[CH]S[CH][CH+]5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4[CH]S[CH][CH+]4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@@H]5[CH]S[CH][CH+]5.[Cl-] 10,11=10,20;20,21=21

Reagent: 140
Reactant Smiles: CCO[C@@]([C@H](C(=O)Cc1ccccc1)[C@@](CC(=O)Cc2ccccc2)(O)OC)([O-])OC
Highest priority first:

Priority: 6975

CCO[C@@:20]([C@H](C(=O)Cc1ccccc1)[C@@](CC(=O)Cc2ccccc2)(O)OC)([O-:10])[O:21]C>>CCO[C@@:20](=[O:10])[C@H](C(=O)Cc1ccccc1)[C@@](CC(=O)Cc2ccccc2)(O)OC.C[O-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CCO[C@@:20]([C@H](C(=O)Cc1ccccc1)[C@@](CC(=O)Cc2ccccc2)(O)OC)([O-:10])[O:21]C>>CCO[C@@:20](=[O:10])[C@H](C(=O)Cc1ccccc1)[C@@](CC(=O)Cc2ccccc2)(O)OC.C[O-:21] 10=20;20,21=21

Priority: 4446

CCO[C@@]([C@H](C(=O)Cc1ccccc1)[C@@](C[C:20](=[O:21])Cc2ccccc2)(O)OC)([O-:10])OC>>CCO[C@]1([C@@H]([C@@](C[C:20]([O:10]1)(Cc2ccccc2)[O-:21])(O)OC)C(=O)Cc3ccccc3)OC
( 5 sp3 None 2 1 pi 2 2 )
n_O > π^*_C=O CCO[C@@]([C@H](C(=O)Cc1ccccc1)[C@@](C[C:20](=[O:21])Cc2ccccc2)(O)OC)([O-:10])OC>>CCO[C@]1([C@@H]([C@@](C[C:20]([O:10]1)(Cc2ccccc2)[O-:21])(O)OC)C(=O)Cc3ccccc3)OC 10=20;20,21=21

Reagent: 3
Reactant Smiles: C[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@@H]3C=CC(=C[CH+]3)C=C)C=C.C=CC1=CC=CC=C1
Highest priority first:

Priority: 2500

C[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@@H]3C=CC(=C[CH+:20]3)C=C)C=C.C=C[C:11]1=[CH:10]C=CC=C1>>C[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@@H]3C=CC(=C[CH:20]3[CH:10]4C=CC=C[C+:11]4C=C)C=C)C=C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@@H]3C=CC(=C[CH+:20]3)C=C)C=C.C=C[C:11]1=[CH:10]C=CC=C1>>C[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@@H]3C=CC(=C[CH:20]3[CH:10]4C=CC=C[C+:11]4C=C)C=C)C=C 10,11=10,20

Priority: 2000

C[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@@H]3C=CC(=C[CH+:20]3)C=C)C=C.C=CC1=C[CH:10]=[CH:11]C=C1>>C[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@@H]3C=CC(=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)C=C)C=C)C=C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@@H]3C=CC(=C[CH+:20]3)C=C)C=C.C=CC1=C[CH:10]=[CH:11]C=C1>>C[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@@H]3C=CC(=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)C=C)C=C)C=C 10,11=10,20

Reagent: 3
Reactant Smiles: CC(C)[C@H]1C=CC=C[C@]1(C=C)[C@H]2C=CC(=C[CH+]2)C=C
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[CH:10]C=C[C@]1(C=C)[C@H]2C=CC(=C[CH+:20]2)C=C>>CC(C)[C@H]1[CH+:11][CH:10]2C=C[C@@]1([C@@H]3[CH:20]2C=C(C=C3)C=C)C=C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[CH:10]C=C[C@]1(C=C)[C@H]2C=CC(=C[CH+:20]2)C=C>>CC(C)[C@H]1[CH+:11][CH:10]2C=C[C@@]1([C@@H]3[CH:20]2C=C(C=C3)C=C)C=C 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=CC=C[C@]1([CH:11]=[CH2:10])[C@H]2C=CC(=C[CH+:20]2)C=C>>CC(C)[C@H]1C=CC=C[C@@]12[CH+:11][CH2:10][CH:20]3[C@@H]2C=CC(=C3)C=C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC=C[C@]1([CH:11]=[CH2:10])[C@H]2C=CC(=C[CH+:20]2)C=C>>CC(C)[C@H]1C=CC=C[C@@]12[CH+:11][CH2:10][CH:20]3[C@@H]2C=CC(=C3)C=C 10,11=10,20

Priority: 7030

CC(C)[C@H]1C=CC=C[C@]1(C=C)[C@H]2C=C[C:11](=[CH:10][CH+:20]2)C=C>>CC(C)[C@H]1C=CC=C[C@]1(C=C)[C@H]2C=C[C+:11]([CH:10]=[CH:20]2)C=C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC=C[C@]1(C=C)[C@H]2C=C[C:11](=[CH:10][CH+:20]2)C=C>>CC(C)[C@H]1C=CC=C[C@]1(C=C)[C@H]2C=C[C+:11]([CH:10]=[CH:20]2)C=C 10,11=10,20

Reagent: 8
Reactant Smiles: c1ccc(cc1)C[C@]2([C@@H](C(=O)C[C@@](O2)([O-])Cl)c3ccccc3)CC(=O)Cl
Highest priority first:

Priority: 6990

c1ccc(cc1)C[C@]2([C@@H](C(=O)C[C@@:20](O2)([O-:10])[Cl:21])c3ccccc3)CC(=O)Cl>>c1ccc(cc1)C[C@]2([C@@H](C(=O)C[C@@:20](=[O:10])O2)c3ccccc3)CC(=O)Cl.[Cl-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-Cl c1ccc(cc1)C[C@]2([C@@H](C(=O)C[C@@:20](O2)([O-:10])[Cl:21])c3ccccc3)CC(=O)Cl>>c1ccc(cc1)C[C@]2([C@@H](C(=O)C[C@@:20](=[O:10])O2)c3ccccc3)CC(=O)Cl.[Cl-:21] 10=20;20,21=21

Priority: 6974

c1ccc(cc1)C[C@]2([C@@H](C(=O)C[C@@:20]([O:21]2)([O-:10])Cl)c3ccccc3)CC(=O)Cl>>c1ccc(cc1)C[C@@](CC(=O)Cl)([C@H](c2ccccc2)C(=O)C[C@@:20](=[O:10])Cl)[O-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O c1ccc(cc1)C[C@]2([C@@H](C(=O)C[C@@:20]([O:21]2)([O-:10])Cl)c3ccccc3)CC(=O)Cl>>c1ccc(cc1)C[C@@](CC(=O)Cl)([C@H](c2ccccc2)C(=O)C[C@@:20](=[O:10])Cl)[O-:21] 10=20;20,21=21

Priority: 4448

c1ccc(cc1)C[C@]2([C@@H](C(=O)C[C@@](O2)([O-:10])Cl)c3ccccc3)C[C:20](=[O:21])Cl>>c1ccc(cc1)C[C@]23C[C:20]([O:10][C@](O2)(CC(=O)[C@H]3c4ccccc4)Cl)([O-:21])Cl
( 5 sp3 None 2 1 pi 2 2 )
n_O > π^*_C=O c1ccc(cc1)C[C@]2([C@@H](C(=O)C[C@@](O2)([O-:10])Cl)c3ccccc3)C[C:20](=[O:21])Cl>>c1ccc(cc1)C[C@]23C[C:20]([O:10][C@](O2)(CC(=O)[C@H]3c4ccccc4)Cl)([O-:21])Cl 10=20;20,21=21

Reagent: 3
Reactant Smiles: C[C@@H]1[C@H]2C=CC=C[C@]2([C@@H]3[C+]1C=CC=C3)C=C
Highest priority first:

Priority: 7084

C[C@@H]1[C@H]2C=CC=C[C@]2([C@@H]3[C+:20]1C=CC=C3)[CH:11]=[CH2:10]>>C[C@@H]1[C@H]2C=CC=C[C@]23[CH+:11][CH2:10][C:20]14[C@@H]3C=CC=C4
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C C[C@@H]1[C@H]2C=CC=C[C@]2([C@@H]3[C+:20]1C=CC=C3)[CH:11]=[CH2:10]>>C[C@@H]1[C@H]2C=CC=C[C@]23[CH+:11][CH2:10][C:20]14[C@@H]3C=CC=C4 10,11=10,20

Priority: 7030

C[C@@H]1[C@H]2C=CC=C[C@]2([C@@H]3[C+:20]1[CH:10]=[CH:11]C=C3)C=C>>C[C@@H]1[C@H]2C=CC=C[C@]2([C@@H]3[C:20]1=[CH:10][CH+:11]C=C3)C=C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C C[C@@H]1[C@H]2C=CC=C[C@]2([C@@H]3[C+:20]1[CH:10]=[CH:11]C=C3)C=C>>C[C@@H]1[C@H]2C=CC=C[C@]2([C@@H]3[C:20]1=[CH:10][CH+:11]C=C3)C=C 10,11=10,20

Reagent: 3
Reactant Smiles: C[C@@H](Cc1ccccc1)[C@@H]2C=CC(=C[C@@H]2[C@@H]3C=CC=C[C+]3CC=C)CC=C
Highest priority first:

Priority: 7084

C[C@@H](Cc1ccccc1)[C@@H]2[CH:11]=[CH:10]C(=C[C@@H]2[C@@H]3C=CC=C[C+:20]3CC=C)CC=C>>C[C@@H](Cc1ccccc1)[C@@H]2[CH+:11][CH:10]3C(=C[C@@H]2[C@H]4[C:20]3(C=CC=C4)CC=C)CC=C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C C[C@@H](Cc1ccccc1)[C@@H]2[CH:11]=[CH:10]C(=C[C@@H]2[C@@H]3C=CC=C[C+:20]3CC=C)CC=C>>C[C@@H](Cc1ccccc1)[C@@H]2[CH+:11][CH:10]3C(=C[C@@H]2[C@H]4[C:20]3(C=CC=C4)CC=C)CC=C 10,11=10,20

Priority: 7082

C[C@@H](Cc1ccccc1)[C@@H]2C=C[C:10](=[CH:11][C@@H]2[C@@H]3C=CC=C[C+:20]3CC=C)CC=C>>C[C@@H](Cc1ccccc1)[C@@H]2C=C[C:10]3([CH+:11][C@@H]2[C@H]4[C:20]3(C=CC=C4)CC=C)CC=C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C C[C@@H](Cc1ccccc1)[C@@H]2C=C[C:10](=[CH:11][C@@H]2[C@@H]3C=CC=C[C+:20]3CC=C)CC=C>>C[C@@H](Cc1ccccc1)[C@@H]2C=C[C:10]3([CH+:11][C@@H]2[C@H]4[C:20]3(C=CC=C4)CC=C)CC=C 10,11=10,20

Priority: 7030

C[C@@H](Cc1ccccc1)[C@@H]2C=CC(=C[C@@H]2[C@@H]3C=C[CH:11]=[CH:10][C+:20]3CC=C)CC=C>>C[C@@H](Cc1ccccc1)[C@@H]2C=CC(=C[C@@H]2[C@@H]3C=C[CH+:11][CH:10]=[C:20]3CC=C)CC=C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C C[C@@H](Cc1ccccc1)[C@@H]2C=CC(=C[C@@H]2[C@@H]3C=C[CH:11]=[CH:10][C+:20]3CC=C)CC=C>>C[C@@H](Cc1ccccc1)[C@@H]2C=CC(=C[C@@H]2[C@@H]3C=C[CH+:11][CH:10]=[C:20]3CC=C)CC=C 10,11=10,20

Reagent: 3
Reactant Smiles: CC(C)C1C=CC(C=C1)(C=C)[C@@H]2C=CC=C([CH+]2)C=C
Highest priority first:

Priority: 7082

CC(C)C1C=CC(C=C1)([CH:11]=[CH2:10])[C@@H]2C=CC=C([CH+:20]2)C=C>>CC(C)C1C=CC2(C=C1)[CH+:11][CH2:10][CH:20]3[C@H]2C=CC=C3C=C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)C1C=CC(C=C1)([CH:11]=[CH2:10])[C@@H]2C=CC=C([CH+:20]2)C=C>>CC(C)C1C=CC2(C=C1)[CH+:11][CH2:10][CH:20]3[C@H]2C=CC=C3C=C 10,11=10,20

Priority: 7030

CC(C)C1C=CC(C=C1)(C=C)[C@@H]2C=C[CH:11]=[C:10]([CH+:20]2)C=C>>CC(C)C1C=CC(C=C1)(C=C)[C@@H]2C=C[CH+:11][C:10](=[CH:20]2)C=C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CC(C)C1C=CC(C=C1)(C=C)[C@@H]2C=C[CH:11]=[C:10]([CH+:20]2)C=C>>CC(C)C1C=CC(C=C1)(C=C)[C@@H]2C=C[CH+:11][C:10](=[CH:20]2)C=C 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2cc(ccc2=C[C@@H]1[C@@H]3C=c4cc(ccc4=C[CH+]3)C#N)C#N.c1ccc2c(c1)C=CC(=C2)C#N
Highest priority first:

Priority: 2731

CC(C)[C@@H]1C=c2cc(ccc2=C[C@@H]1[C@@H]3C=c4cc(ccc4=C[CH+:20]3)C#N)C#N.c1ccc2c(c1)[CH:10]=[CH:11]C(=C2)C#N>>CC(C)[C@@H]1C=c2cc(ccc2=C[C@@H]1[C@@H]3C=c4cc(ccc4=C[CH:20]3[CH:10]5[CH+:11]C(=Cc6c5cccc6)C#N)C#N)C#N
( 3 pi 2 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2cc(ccc2=C[C@@H]1[C@@H]3C=c4cc(ccc4=C[CH+:20]3)C#N)C#N.c1ccc2c(c1)[CH:10]=[CH:11]C(=C2)C#N>>CC(C)[C@@H]1C=c2cc(ccc2=C[C@@H]1[C@@H]3C=c4cc(ccc4=C[CH:20]3[CH:10]5[CH+:11]C(=Cc6c5cccc6)C#N)C#N)C#N 10,11=10,20

Priority: 2540

CC(C)[C@@H]1C=c2cc(ccc2=C[C@@H]1[C@@H]3C=c4cc(ccc4=C[CH+:20]3)C#N)C#N.c1ccc2c(c1)C=C[C:11](=[CH:10]2)C#N>>CC(C)[C@@H]1C=c2cc(ccc2=C[C@@H]1[C@@H]3C=c4cc(ccc4=C[CH:20]3[CH:10]5c6ccccc6C=C[C+:11]5C#N)C#N)C#N
( 3 pi 2 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2cc(ccc2=C[C@@H]1[C@@H]3C=c4cc(ccc4=C[CH+:20]3)C#N)C#N.c1ccc2c(c1)C=C[C:11](=[CH:10]2)C#N>>CC(C)[C@@H]1C=c2cc(ccc2=C[C@@H]1[C@@H]3C=c4cc(ccc4=C[CH:20]3[CH:10]5c6ccccc6C=C[C+:11]5C#N)C#N)C#N 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2ccc(cc2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH+]3)[N+](=O)[O-])[N+](=O)[O-].CC(C)[C@@H]1C=C2C=CC(=CC2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH+]3)[N+](=O)[O-])[N+](=O)[O-]
Highest priority first:

Priority: 2801

CC(C)[C@@H]1C=c2ccc(cc2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH+:20]3)[N+](=O)[O-])[N+](=O)[O-].CC(C)[C@@H]1C=C2[CH:10]=[CH:11]C(=CC2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH+]3)[N+](=O)[O-])[N+](=O)[O-]>>CC(C)[C@@H]1C=c2ccc(cc2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH:20]3[CH:10]5[CH+:11]C(=CC6=C[C@H]([C@@H](C=C56)C(C)C)[C@@H]7C=c8ccc(cc8=C[CH+]7)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
( 3 pi 2 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2ccc(cc2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH+:20]3)[N+](=O)[O-])[N+](=O)[O-].CC(C)[C@@H]1C=C2[CH:10]=[CH:11]C(=CC2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH+]3)[N+](=O)[O-])[N+](=O)[O-]>>CC(C)[C@@H]1C=c2ccc(cc2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH:20]3[CH:10]5[CH+:11]C(=CC6=C[C@H]([C@@H](C=C56)C(C)C)[C@@H]7C=c8ccc(cc8=C[CH+]7)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] 10,11=10,20

Priority: 2000

CC(C)[C@@H]1C=c2ccc(cc2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH+:20]3)[N+](=O)[O-])[N+](=O)[O-].CC(C)[C@@H]1C=C2C=[CH:10][C:11](=CC2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH+]3)[N+](=O)[O-])[N+](=O)[O-]>>CC(C)[C@@H]1C=c2ccc(cc2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH:20]3[CH:10]=CC5=C[C@H]([C@@H](C=C5C=[C+:11][N+](=O)[O-])[C@@H]6C=c7ccc(cc7=C[CH+]6)[N+](=O)[O-])C(C)C)[N+](=O)[O-])[N+](=O)[O-]
( 2 sigma 1 2 5 p None 0 )
σ_C-C > p_C CC(C)[C@@H]1C=c2ccc(cc2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH+:20]3)[N+](=O)[O-])[N+](=O)[O-].CC(C)[C@@H]1C=C2C=[CH:10][C:11](=CC2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH+]3)[N+](=O)[O-])[N+](=O)[O-]>>CC(C)[C@@H]1C=c2ccc(cc2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH:20]3[CH:10]=CC5=C[C@H]([C@@H](C=C5C=[C+:11][N+](=O)[O-])[C@@H]6C=c7ccc(cc7=C[CH+]6)[N+](=O)[O-])C(C)C)[N+](=O)[O-])[N+](=O)[O-] 10,11=10,20

Reagent: 8
Reactant Smiles: COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Priority: 2955

COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Reagent: 5
Reactant Smiles: C[CH+][C@@]([OH2+])(O)OC(=O)C
Highest priority first:

Priority: 6973

C[CH+][C@@:20]([OH2+:21])([OH:10])OC(=O)C>>C[CH+][C@@:20](=[OH+:10])OC(=O)C.[OH2:21]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-O C[CH+][C@@:20]([OH2+:21])([OH:10])OC(=O)C>>C[CH+][C@@:20](=[OH+:10])OC(=O)C.[OH2:21] 10=20;20,21=21

Priority: 6970

C[CH+][C@@:20]([OH2+:21])(O)[O:10]C(=O)C>>C[CH+][C@:20](=[O+:10]C(=O)C)O.[OH2:21]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-O C[CH+][C@@:20]([OH2+:21])(O)[O:10]C(=O)C>>C[CH+][C@:20](=[O+:10]C(=O)C)O.[OH2:21] 10=20;20,21=21

Priority: 6953

C[CH+][C@@:20]([OH2+])([OH:10])[O:21]C(=O)C>>C[CH+][C@@:20](=[OH+:10])[OH2+].CC(=O)[O-:21]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-O C[CH+][C@@:20]([OH2+])([OH:10])[O:21]C(=O)C>>C[CH+][C@@:20](=[OH+:10])[OH2+].CC(=O)[O-:21] 10=20;20,21=21

Priority: 4100

C[CH+][C@@:20]([OH2+:21])(O)OC(=O)C>>C[CH+][C@@+:20](O)OC(=O)C.[OH2:21]
( 1 sigma 2 2 1 sigma 2 2 )
σ_C-O > σ^*_C-O C[CH+][C@@:20]([OH2+:21])(O)OC(=O)C>>C[CH+][C@@+:20](O)OC(=O)C.[OH2:21] 20,21=21

Reagent: 8
Reactant Smiles: CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Priority: 2955

CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Reagent: 3
Reactant Smiles: C[C@@H]1CCC[C@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C+]3CCCC=C.C=CCCCC1=CC=CC=C1
Highest priority first:

Priority: 2500

C[C@@H]1CCC[C@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C+:20]3CCCC=C.C=CCCC[C:11]1=[CH:10]C=CC=C1>>C[C@@H]1CCC[C@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C:20]3(CCCC=C)[CH:10]4C=CC=C[C+:11]4CCCC=C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C@@H]1CCC[C@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C+:20]3CCCC=C.C=CCCC[C:11]1=[CH:10]C=CC=C1>>C[C@@H]1CCC[C@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C:20]3(CCCC=C)[CH:10]4C=CC=C[C+:11]4CCCC=C 10,11=10,20

Priority: 2000

C[C@@H]1CCC[C@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C+:20]3CCCC=C.C=CCCCC1=C[CH:10]=[CH:11]C=C1>>C[C@@H]1CCC[C@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C:20]3(CCCC=C)[CH:10]4C=C(C=C[CH+:11]4)CCCC=C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C@@H]1CCC[C@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C+:20]3CCCC=C.C=CCCCC1=C[CH:10]=[CH:11]C=C1>>C[C@@H]1CCC[C@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C:20]3(CCCC=C)[CH:10]4C=C(C=C[CH+:11]4)CCCC=C 10,11=10,20

Reagent: 3
Reactant Smiles: CC[NH2+][C@]1(CC[C@@](O1)([O-])OCC)Cl
Highest priority first:

Priority: 6975

CC[NH2+][C@]1(CC[C@@:20](O1)([O-:10])[O:21]CC)Cl>>CC[NH2+][C@]1(CC[C@@:20](=[O:10])O1)Cl.CC[O-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CC[NH2+][C@]1(CC[C@@:20](O1)([O-:10])[O:21]CC)Cl>>CC[NH2+][C@]1(CC[C@@:20](=[O:10])O1)Cl.CC[O-:21] 10=20;20,21=21

Priority: 6970

CC[NH2+:21][C@:20]1(CC[C@@]([O:10]1)([O-])OCC)Cl>>CC[NH2:21].CCO[C@@]1(CC[C@@:20](=[O+:10]1)Cl)[O-]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-N CC[NH2+:21][C@:20]1(CC[C@@]([O:10]1)([O-])OCC)Cl>>CC[NH2:21].CCO[C@@]1(CC[C@@:20](=[O+:10]1)Cl)[O-] 10=20;20,21=21

Priority: 6960

CC[NH2+][C@:20]1(CC[C@@]([O:10]1)([O-])OCC)[Cl:21]>>CC[NH2+][C@:20]1=[O+:10][C@](CC1)([O-])OCC.[Cl-:21]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-Cl CC[NH2+][C@:20]1(CC[C@@]([O:10]1)([O-])OCC)[Cl:21]>>CC[NH2+][C@:20]1=[O+:10][C@](CC1)([O-])OCC.[Cl-:21] 10=20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=C(C=C2[C@]1(C=CC=C2)[C@H]3C=Cc4cc(ccc4[CH+]3)C(=O)C)C(=O)C
Highest priority first:

Priority: 7084

CC(C)[C@@H]1[CH:11]=[C:10](C=C2[C@]1(C=CC=C2)[C@H]3C=Cc4cc(ccc4[CH+:20]3)C(=O)C)C(=O)C>>CC(C)[C@@H]1[CH+:11][C:10]2(C=C3[C@]1(C=CC=C3)[C@@H]4[CH:20]2c5ccc(cc5C=C4)C(=O)C)C(=O)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH:11]=[C:10](C=C2[C@]1(C=CC=C2)[C@H]3C=Cc4cc(ccc4[CH+:20]3)C(=O)C)C(=O)C>>CC(C)[C@@H]1[CH+:11][C:10]2(C=C3[C@]1(C=CC=C3)[C@@H]4[CH:20]2c5ccc(cc5C=C4)C(=O)C)C(=O)C 10,11=10,20

Priority: 7082

CC(C)[C@@H]1C=C(C=C2[C@]1([CH:11]=[CH:10]C=C2)[C@H]3C=Cc4cc(ccc4[CH+:20]3)C(=O)C)C(=O)C>>CC(C)[C@@H]1C=C(C=C2[C@@]13[CH+:11][CH:10](C=C2)[CH:20]4[C@@H]3C=Cc5c4ccc(c5)C(=O)C)C(=O)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C(C=C2[C@]1([CH:11]=[CH:10]C=C2)[C@H]3C=Cc4cc(ccc4[CH+:20]3)C(=O)C)C(=O)C>>CC(C)[C@@H]1C=C(C=C2[C@@]13[CH+:11][CH:10](C=C2)[CH:20]4[C@@H]3C=Cc5c4ccc(c5)C(=O)C)C(=O)C 10,11=10,20

Reagent: 8
Reactant Smiles: CCO[C@@](CC(=[OH+])Cc1ccccc1)([O-])OC(=O)c2ccccc2
Highest priority first:

Priority: 6983

CCO[C@@:20](CC(=[OH+])Cc1ccccc1)([O-:10])[O:21]C(=O)c2ccccc2>>CCO[C@@:20](=[O:10])CC(=[OH+])Cc1ccccc1.c1ccc(cc1)C(=O)[O-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CCO[C@@:20](CC(=[OH+])Cc1ccccc1)([O-:10])[O:21]C(=O)c2ccccc2>>CCO[C@@:20](=[O:10])CC(=[OH+])Cc1ccccc1.c1ccc(cc1)C(=O)[O-:21] 10=20;20,21=21

Priority: 6975

CC[O:21][C@@:20](CC(=[OH+])Cc1ccccc1)([O-:10])OC(=O)c2ccccc2>>CC[O-:21].c1ccc(cc1)CC(=[OH+])C[C@@:20](=[O:10])OC(=O)c2ccccc2
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CC[O:21][C@@:20](CC(=[OH+])Cc1ccccc1)([O-:10])OC(=O)c2ccccc2>>CC[O-:21].c1ccc(cc1)CC(=[OH+])C[C@@:20](=[O:10])OC(=O)c2ccccc2 10=20;20,21=21

Reagent: 3
Reactant Smiles: CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)Cc2ccccc2)[C@@H]3C=CC=C[C+]3C=C(C)C)C.CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)CC2=CC=CC=C2)[C@@H]3C=CC=C[C+]3C=C(C)C)C
Highest priority first:

Priority: 2500

CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)Cc2ccccc2)[C@@H]3C=CC=C[C+:20]3C=C(C)C)C.CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)C[C:11]2=[CH:10]C=CC=C2)[C@@H]3C=CC=C[C+]3C=C(C)C)C>>CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)Cc2ccccc2)[C@@H]3C=CC=C[C:20]3(C=C(C)C)[CH:10]4C=CC=C[C+:11]4CC(C)(C)[C@@H]5C=CC(=C[C@H]5[C@@H]6C=CC=C[C+]6C=C(C)C)C=C(C)C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)Cc2ccccc2)[C@@H]3C=CC=C[C+:20]3C=C(C)C)C.CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)C[C:11]2=[CH:10]C=CC=C2)[C@@H]3C=CC=C[C+]3C=C(C)C)C>>CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)Cc2ccccc2)[C@@H]3C=CC=C[C:20]3(C=C(C)C)[CH:10]4C=CC=C[C+:11]4CC(C)(C)[C@@H]5C=CC(=C[C@H]5[C@@H]6C=CC=C[C+]6C=C(C)C)C=C(C)C)C 10,11=10,20

Priority: 2000

CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)Cc2ccccc2)[C@@H]3C=CC=C[C+:20]3C=C(C)C)C.CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)CC2=C[CH:10]=[CH:11]C=C2)[C@@H]3C=CC=C[C+]3C=C(C)C)C>>CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)Cc2ccccc2)[C@@H]3C=CC=C[C:20]3(C=C(C)C)[CH:10]4C=C(C=C[CH+:11]4)CC(C)(C)[C@@H]5C=CC(=C[C@H]5[C@@H]6C=CC=C[C+]6C=C(C)C)C=C(C)C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)Cc2ccccc2)[C@@H]3C=CC=C[C+:20]3C=C(C)C)C.CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)CC2=C[CH:10]=[CH:11]C=C2)[C@@H]3C=CC=C[C+]3C=C(C)C)C>>CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)Cc2ccccc2)[C@@H]3C=CC=C[C:20]3(C=C(C)C)[CH:10]4C=C(C=C[CH+:11]4)CC(C)(C)[C@@H]5C=CC(=C[C@H]5[C@@H]6C=CC=C[C+]6C=C(C)C)C=C(C)C)C 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=C2C3=CC=C[C@]2([C@H]1[CH+]3)C#N.c1cc2c(c(c1)C#N)C=CC=C2
Highest priority first:

Priority: 2830

CC(C)[C@@H]1C=C2C3=CC=C[C@]2([C@H]1[CH+:20]3)C#N.c1cc2c(c(c1)C#N)C=C[CH:11]=[CH:10]2>>CC(C)[C@@H]1C=C2C3=CC=C[C@]2([C@H]1[CH:20]3[CH:10]4[CH+:11]C=Cc5c4cccc5C#N)C#N
( 3 pi 2 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C2C3=CC=C[C@]2([C@H]1[CH+:20]3)C#N.c1cc2c(c(c1)C#N)C=C[CH:11]=[CH:10]2>>CC(C)[C@@H]1C=C2C3=CC=C[C@]2([C@H]1[CH:20]3[CH:10]4[CH+:11]C=Cc5c4cccc5C#N)C#N 10,11=10,20

Priority: 2000

CC(C)[C@@H]1C=C2C3=CC=C[C@]2([C@H]1[CH+:20]3)C#N.c1cc2c(c(c1)C#N)C=C[CH:10]=[CH:11]2>>CC(C)[C@@H]1C=C2C3=CC=C[C@]2([C@H]1[CH:20]3[CH:10]4C=Cc5c(cccc5C#N)[CH+:11]4)C#N
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C2C3=CC=C[C@]2([C@H]1[CH+:20]3)C#N.c1cc2c(c(c1)C#N)C=C[CH:10]=[CH:11]2>>CC(C)[C@@H]1C=C2C3=CC=C[C@]2([C@H]1[CH:20]3[CH:10]4C=Cc5c(cccc5C#N)[CH+:11]4)C#N 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=CC=C2[C@@]1(C=C(C=C2)[N+](=O)[O-])[C@H]3[CH+]C=Cc4c3cc(cc4)[N+](=O)[O-]
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[CH:10]C=C2[C@@]1(C=C(C=C2)[N+](=O)[O-])[C@H]3[CH+:20]C=Cc4c3cc(cc4)[N+](=O)[O-]>>CC(C)[C@H]1[CH+:11][CH:10]2C=C3[C@@]1(C=C(C=C3)[N+](=O)[O-])[C@H]4[CH:20]2C=Cc5c4cc(cc5)[N+](=O)[O-]
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[CH:10]C=C2[C@@]1(C=C(C=C2)[N+](=O)[O-])[C@H]3[CH+:20]C=Cc4c3cc(cc4)[N+](=O)[O-]>>CC(C)[C@H]1[CH+:11][CH:10]2C=C3[C@@]1(C=C(C=C3)[N+](=O)[O-])[C@H]4[CH:20]2C=Cc5c4cc(cc5)[N+](=O)[O-] 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=CC=C2[C@@]1([CH:11]=[C:10](C=C2)[N+](=O)[O-])[C@H]3[CH+:20]C=Cc4c3cc(cc4)[N+](=O)[O-]>>CC(C)[C@H]1C=CC=C2[C@]13[CH+:11][C:10](C=C2)([CH:20]4[C@H]3c5cc(ccc5C=C4)[N+](=O)[O-])[N+](=O)[O-]
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC=C2[C@@]1([CH:11]=[C:10](C=C2)[N+](=O)[O-])[C@H]3[CH+:20]C=Cc4c3cc(cc4)[N+](=O)[O-]>>CC(C)[C@H]1C=CC=C2[C@]13[CH+:11][C:10](C=C2)([CH:20]4[C@H]3c5cc(ccc5C=C4)[N+](=O)[O-])[N+](=O)[O-] 10,11=10,20

Reagent: 87
Reactant Smiles: [1H]CC(=O)[C@@H](CCCCBr)C(=O)C[C@](C)([C@@H](CCCCBr)C(=O)C)O.[OH-]
Highest priority first:

Priority: 4377

[H:20][CH2:21][C:22](=[O:23])[C@@H](CCCCBr)C(=O)C[C@](C)([C@@H](CCCCBr)C(=O)C)O.[OH-:10]>>[H:20][OH:10].CC(=O)[C@H](CCCCBr)[C@@](C)(CC(=O)[C@H](CCCCBr)[C:22](=[CH2:21])[O-:23])O
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH2:21][C:22](=[O:23])[C@@H](CCCCBr)C(=O)C[C@](C)([C@@H](CCCCBr)C(=O)C)O.[OH-:10]>>[H:20][OH:10].CC(=O)[C@H](CCCCBr)[C@@](C)(CC(=O)[C@H](CCCCBr)[C:22](=[CH2:21])[O-:23])O 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][CH2:21]C(=O)[C@@H](CCCCBr)C(=O)C[C@](C)([C@@H](CCCCBr)C(=O)C)O.[OH-:10]>>[H:20][OH:10].CC(=O)[C@H](CCCCBr)[C@@](C)(CC(=O)[C@H](CCCCBr)C(=O)[CH2-:21])O
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH2:21]C(=O)[C@@H](CCCCBr)C(=O)C[C@](C)([C@@H](CCCCBr)C(=O)C)O.[OH-:10]>>[H:20][OH:10].CC(=O)[C@H](CCCCBr)[C@@](C)(CC(=O)[C@H](CCCCBr)C(=O)[CH2-:21])O 10=20;20,21=21

Reagent: 3
Reactant Smiles: CO/C=C/C1=CC=C[C@H]([C@@H]1[C@@H]2C=CC=C[C+]2/C=C/OC)[C@H](Cc3ccccc3)OC
Highest priority first:

Priority: 7084

CO/[CH:10]=[CH:11]/C1=CC=C[C@H]([C@@H]1[C@@H]2C=CC=C[C+:20]2/C=C/OC)[C@H](Cc3ccccc3)OC>>CO/C=C/[C:20]12C=CC=C[C@H]1[C@H]3[C@@H](C=CC=C3[CH+:11][CH:10]2OC)[C@H](Cc4ccccc4)OC
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CO/[CH:10]=[CH:11]/C1=CC=C[C@H]([C@@H]1[C@@H]2C=CC=C[C+:20]2/C=C/OC)[C@H](Cc3ccccc3)OC>>CO/C=C/[C:20]12C=CC=C[C@H]1[C@H]3[C@@H](C=CC=C3[CH+:11][CH:10]2OC)[C@H](Cc4ccccc4)OC 10,11=10,20

Priority: 7082

CO/C=C/[C:11]1=[CH:10]C=C[C@H]([C@@H]1[C@@H]2C=CC=C[C+:20]2/C=C/OC)[C@H](Cc3ccccc3)OC>>CO/C=C/[C+:11]1[CH:10]2C=C[C@H]([C@@H]1[C@H]3[C:20]2(C=CC=C3)/C=C/OC)[C@H](Cc4ccccc4)OC
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CO/C=C/[C:11]1=[CH:10]C=C[C@H]([C@@H]1[C@@H]2C=CC=C[C+:20]2/C=C/OC)[C@H](Cc3ccccc3)OC>>CO/C=C/[C+:11]1[CH:10]2C=C[C@H]([C@@H]1[C@H]3[C:20]2(C=CC=C3)/C=C/OC)[C@H](Cc4ccccc4)OC 10,11=10,20

Priority: 7030

CO/C=C/C1=CC=C[C@H]([C@@H]1[C@@H]2C=CC=C[C+:20]2/[CH:10]=[CH:11]/OC)[C@H](Cc3ccccc3)OC>>CO/C=C/C1=CC=C[C@H]([C@@H]1[C@@H]2C=CC=C[C:20]2=[CH:10][CH+:11]OC)[C@H](Cc3ccccc3)OC
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CO/C=C/C1=CC=C[C@H]([C@@H]1[C@@H]2C=CC=C[C+:20]2/[CH:10]=[CH:11]/OC)[C@H](Cc3ccccc3)OC>>CO/C=C/C1=CC=C[C@H]([C@@H]1[C@@H]2C=CC=C[C:20]2=[CH:10][CH+:11]OC)[C@H](Cc3ccccc3)OC 10,11=10,20

Reagent: 3
Reactant Smiles: C[C@H]1CC[C@]2([C@@H]1C=CC=C2)[C@@H]3C=CC=C([CH+]3)CCC=C.C=CCCC1=CC=CC=C1
Highest priority first:

Priority: 2500

C[C@H]1CC[C@]2([C@@H]1C=CC=C2)[C@@H]3C=CC=C([CH+:20]3)CCC=C.C=CCC[C:11]1=[CH:10]C=CC=C1>>C[C@H]1CC[C@]2([C@@H]1C=CC=C2)[C@@H]3C=CC=C([CH:20]3[CH:10]4C=CC=C[C+:11]4CCC=C)CCC=C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C@H]1CC[C@]2([C@@H]1C=CC=C2)[C@@H]3C=CC=C([CH+:20]3)CCC=C.C=CCC[C:11]1=[CH:10]C=CC=C1>>C[C@H]1CC[C@]2([C@@H]1C=CC=C2)[C@@H]3C=CC=C([CH:20]3[CH:10]4C=CC=C[C+:11]4CCC=C)CCC=C 10,11=10,20

Priority: 2000

C[C@H]1CC[C@]2([C@@H]1C=CC=C2)[C@@H]3C=CC=C([CH+:20]3)CCC=C.C=CCCC1=C[CH:10]=[CH:11]C=C1>>C[C@H]1CC[C@]2([C@@H]1C=CC=C2)[C@@H]3C=CC=C([CH:20]3[CH:10]4C=C(C=C[CH+:11]4)CCC=C)CCC=C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C@H]1CC[C@]2([C@@H]1C=CC=C2)[C@@H]3C=CC=C([CH+:20]3)CCC=C.C=CCCC1=C[CH:10]=[CH:11]C=C1>>C[C@H]1CC[C@]2([C@@H]1C=CC=C2)[C@@H]3C=CC=C([CH:20]3[CH:10]4C=C(C=C[CH+:11]4)CCC=C)CCC=C 10,11=10,20

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]
Highest priority first:

Priority: 2955

c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-] 10,11=10,20;20,21=21

Reagent: 28
Reactant Smiles: CC(=O)[C@H]1C=Cc2ccc(cc2[CH+]1)Br.CC(=O)[C@H]1C=CC2=CC=C(C=C2[CH+]1)Br
Highest priority first:

Priority: 2600

CC(=O)[C@H]1C=Cc2ccc(cc2[CH+:20]1)Br.CC(=O)[C@H]1C=CC2=C[CH:10]=[C:11](C=C2[CH+]1)Br>>CC(=O)[C@H]1C=CC2=C[CH:10]([C+:11](C=C2[CH+]1)Br)[CH:20]3c4cc(ccc4C=C[C@@H]3C(=O)C)Br
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(=O)[C@H]1C=Cc2ccc(cc2[CH+:20]1)Br.CC(=O)[C@H]1C=CC2=C[CH:10]=[C:11](C=C2[CH+]1)Br>>CC(=O)[C@H]1C=CC2=C[CH:10]([C+:11](C=C2[CH+]1)Br)[CH:20]3c4cc(ccc4C=C[C@@H]3C(=O)C)Br 10,11=10,20

Priority: 2000

CC(=O)[C@H]1C=Cc2ccc(cc2[CH+:20]1)Br.CC(=O)[C@H]1C=C[C:11]2=[CH:10]C=C(C=C2[CH+]1)Br>>CC(=O)[C@H]1C=C[C+:11]2[CH:10](C=C(C=C2[CH+]1)Br)[CH:20]3c4cc(ccc4C=C[C@@H]3C(=O)C)Br
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(=O)[C@H]1C=Cc2ccc(cc2[CH+:20]1)Br.CC(=O)[C@H]1C=C[C:11]2=[CH:10]C=C(C=C2[CH+]1)Br>>CC(=O)[C@H]1C=C[C+:11]2[CH:10](C=C(C=C2[CH+]1)Br)[CH:20]3c4cc(ccc4C=C[C@@H]3C(=O)C)Br 10,11=10,20

Reagent: 8
Reactant Smiles: CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Priority: 2955

CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=CC(=C2[C@@]1(C=CC=C2)[C@@H]3C=C(c4ccccc4[CH+]3)C#N)C#N
Highest priority first:

Priority: 7084

CC(C)[C@@H]1[CH:11]=[CH:10]C(=C2[C@@]1(C=CC=C2)[C@@H]3C=C(c4ccccc4[CH+:20]3)C#N)C#N>>CC(C)[C@@H]1[CH+:11][CH:10]2[CH:20]3c4ccccc4C(=C[C@H]3[C@@]15C=CC=CC5=C2C#N)C#N
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH:11]=[CH:10]C(=C2[C@@]1(C=CC=C2)[C@@H]3C=C(c4ccccc4[CH+:20]3)C#N)C#N>>CC(C)[C@@H]1[CH+:11][CH:10]2[CH:20]3c4ccccc4C(=C[C@H]3[C@@]15C=CC=CC5=C2C#N)C#N 10,11=10,20

Priority: 7082

CC(C)[C@@H]1C=CC(=C2[C@@]1([CH:11]=[CH:10]C=C2)[C@@H]3C=C(c4ccccc4[CH+:20]3)C#N)C#N>>CC(C)[C@@H]1C=CC(=C2[C@]13[CH+:11][CH:10](C=C2)[CH:20]4[C@H]3C=C(c5c4cccc5)C#N)C#N
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=CC(=C2[C@@]1([CH:11]=[CH:10]C=C2)[C@@H]3C=C(c4ccccc4[CH+:20]3)C#N)C#N>>CC(C)[C@@H]1C=CC(=C2[C@]13[CH+:11][CH:10](C=C2)[CH:20]4[C@H]3C=C(c5c4cccc5)C#N)C#N 10,11=10,20

Reagent: 8
Reactant Smiles: C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=CC=CC=C4)N(C)C.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Priority: 2955

C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C:11]4=[CH:10]C=CC=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C:11]4=[CH:10]C=CC=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=CC=C[CH:10]=[CH:11]4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=CC=C[CH:10]=[CH:11]4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=C[CH:10]=[CH:11]C=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=C[CH:10]=[CH:11]C=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-] 10,11=10,20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=CC(=C([CH+]1)Br)OC.COC1=CC=CC=C1Br
Highest priority first:

Priority: 2950

CC(C)[C@@H]1C=CC(=C([CH+:20]1)Br)OC.CO[C:11]1=[CH:10]C=CC=C1Br>>CC(C)[C@@H]1C=CC(=C([CH:20]1[CH:10]2C=CC=C([C+:11]2OC)Br)Br)OC
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=CC(=C([CH+:20]1)Br)OC.CO[C:11]1=[CH:10]C=CC=C1Br>>CC(C)[C@@H]1C=CC(=C([CH:20]1[CH:10]2C=CC=C([C+:11]2OC)Br)Br)OC 10,11=10,20

Priority: 2600

CC(C)[C@@H]1C=CC(=C([CH+:20]1)Br)OC.COC1=CC=C[CH:10]=[C:11]1Br>>CC(C)[C@@H]1C=CC(=C([CH:20]1[CH:10]2C=CC=C([C+:11]2Br)OC)Br)OC
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=CC(=C([CH+:20]1)Br)OC.COC1=CC=C[CH:10]=[C:11]1Br>>CC(C)[C@@H]1C=CC(=C([CH:20]1[CH:10]2C=CC=C([C+:11]2Br)OC)Br)OC 10,11=10,20

Priority: 2000

CC(C)[C@@H]1C=CC(=C([CH+:20]1)Br)OC.COC1=C[CH:10]=[CH:11]C=C1Br>>CC(C)[C@@H]1C=CC(=C([CH:20]1[CH:10]2C=C(C(=C[CH+:11]2)Br)OC)Br)OC
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=CC(=C([CH+:20]1)Br)OC.COC1=C[CH:10]=[CH:11]C=C1Br>>CC(C)[C@@H]1C=CC(=C([CH:20]1[CH:10]2C=C(C(=C[CH+:11]2)Br)OC)Br)OC 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=CC(=C[C@@H]1[C@@H]2C=CC=C[C+]2C(C)C)C(C)C
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[CH:10]C(=C[C@@H]1[C@@H]2C=CC=C[C+:20]2C(C)C)C(C)C>>CC(C)[C@H]1[CH+:11][CH:10]2C(=C[C@@H]1[C@H]3[C:20]2(C=CC=C3)C(C)C)C(C)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[CH:10]C(=C[C@@H]1[C@@H]2C=CC=C[C+:20]2C(C)C)C(C)C>>CC(C)[C@H]1[CH+:11][CH:10]2C(=C[C@@H]1[C@H]3[C:20]2(C=CC=C3)C(C)C)C(C)C 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=C[C:10](=[CH:11][C@@H]1[C@@H]2C=CC=C[C+:20]2C(C)C)C(C)C>>CC(C)[C@H]1C=C[C:10]2([CH+:11][C@@H]1[C@H]3[C:20]2(C=CC=C3)C(C)C)C(C)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=C[C:10](=[CH:11][C@@H]1[C@@H]2C=CC=C[C+:20]2C(C)C)C(C)C>>CC(C)[C@H]1C=C[C:10]2([CH+:11][C@@H]1[C@H]3[C:20]2(C=CC=C3)C(C)C)C(C)C 10,11=10,20

Reagent: 3
Reactant Smiles: CO/C=C/[C+]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](Cc3ccccc3)OC)/C=C/OC.CO/C=C/[C+]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](CC3=CC=CC=C3)OC)/C=C/OC
Highest priority first:

Priority: 2500

CO/C=C/[C+:20]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](Cc3ccccc3)OC)/C=C/OC.CO/C=C/[C+]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](C[C:11]3=[CH:10]C=CC=C3)OC)/C=C/OC>>CO/C=C/[C+]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](C[C+:11]3C=CC=C[CH:10]3[C:20]4(C=CC(C=C4)C5(C=CC(C=C5)[C@H](Cc6ccccc6)OC)/C=C/OC)/C=C/OC)OC)/C=C/OC
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CO/C=C/[C+:20]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](Cc3ccccc3)OC)/C=C/OC.CO/C=C/[C+]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](C[C:11]3=[CH:10]C=CC=C3)OC)/C=C/OC>>CO/C=C/[C+]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](C[C+:11]3C=CC=C[CH:10]3[C:20]4(C=CC(C=C4)C5(C=CC(C=C5)[C@H](Cc6ccccc6)OC)/C=C/OC)/C=C/OC)OC)/C=C/OC 10,11=10,20

Priority: 2000

CO/C=C/[C+:20]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](Cc3ccccc3)OC)/C=C/OC.CO/C=C/[C+]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](CC3=C[CH:10]=[CH:11]C=C3)OC)/C=C/OC>>CO/C=C/[C+]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](CC3=C[CH:10]([CH+:11]C=C3)[C:20]4(C=CC(C=C4)C5(C=CC(C=C5)[C@H](Cc6ccccc6)OC)/C=C/OC)/C=C/OC)OC)/C=C/OC
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CO/C=C/[C+:20]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](Cc3ccccc3)OC)/C=C/OC.CO/C=C/[C+]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](CC3=C[CH:10]=[CH:11]C=C3)OC)/C=C/OC>>CO/C=C/[C+]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](CC3=C[CH:10]([CH+:11]C=C3)[C:20]4(C=CC(C=C4)C5(C=CC(C=C5)[C@H](Cc6ccccc6)OC)/C=C/OC)/C=C/OC)OC)/C=C/OC 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=CC=C2[C@]1(C=CC(=C2)C#N)[C@@H]3C=C(C=C4[C+]3C=CC=C4)C#N
Highest priority first:

Priority: 7084

CC(C)[C@@H]1[CH:11]=[CH:10]C=C2[C@]1(C=CC(=C2)C#N)[C@@H]3C=C(C=C4[C+:20]3C=CC=C4)C#N>>CC(C)[C@@H]1[CH+:11][CH:10]2C=C3[C@]1(C=CC(=C3)C#N)[C@H]4[C:20]25C=CC=CC5=CC(=C4)C#N
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH:11]=[CH:10]C=C2[C@]1(C=CC(=C2)C#N)[C@@H]3C=C(C=C4[C+:20]3C=CC=C4)C#N>>CC(C)[C@@H]1[CH+:11][CH:10]2C=C3[C@]1(C=CC(=C3)C#N)[C@H]4[C:20]25C=CC=CC5=CC(=C4)C#N 10,11=10,20

Priority: 7082

CC(C)[C@@H]1C=CC=C2[C@]1([CH:11]=[CH:10]C(=C2)C#N)[C@@H]3C=C(C=C4[C+:20]3C=CC=C4)C#N>>CC(C)[C@@H]1C=CC=C2[C@@]13[CH+:11][CH:10](C(=C2)C#N)[C:20]45[C@H]3C=C(C=C4C=CC=C5)C#N
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=CC=C2[C@]1([CH:11]=[CH:10]C(=C2)C#N)[C@@H]3C=C(C=C4[C+:20]3C=CC=C4)C#N>>CC(C)[C@@H]1C=CC=C2[C@@]13[CH+:11][CH:10](C(=C2)C#N)[C:20]45[C@H]3C=C(C=C4C=CC=C5)C#N 10,11=10,20

Reagent: 3
Reactant Smiles: C/C=C/C1=CC=C[C@H]([C@@H]1[C@H]2C=CC=C[C+]2/C=C/C)[C@H](C)Cc3ccccc3.C/C=C/C1=CC=C[C@H]([C@@H]1[C@H]2C=CC=C[C+]2/C=C/C)[C@H](C)CC3=CC=CC=C3
Highest priority first:

Priority: 2500

C/C=C/C1=CC=C[C@H]([C@@H]1[C@H]2C=CC=C[C+:20]2/C=C/C)[C@H](C)Cc3ccccc3.C/C=C/C1=CC=C[C@H]([C@@H]1[C@H]2C=CC=C[C+]2/C=C/C)[C@H](C)C[C:11]3=[CH:10]C=CC=C3>>C/C=C/C1=CC=C[C@H]([C@@H]1[C@H]2C=CC=C[C+]2/C=C/C)[C@H](C)C[C+:11]3C=CC=C[CH:10]3[C:20]4(C=CC=C[C@@H]4[C@H]5[C@@H](C=CC=C5/C=C/C)[C@H](C)Cc6ccccc6)/C=C/C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C/C=C/C1=CC=C[C@H]([C@@H]1[C@H]2C=CC=C[C+:20]2/C=C/C)[C@H](C)Cc3ccccc3.C/C=C/C1=CC=C[C@H]([C@@H]1[C@H]2C=CC=C[C+]2/C=C/C)[C@H](C)C[C:11]3=[CH:10]C=CC=C3>>C/C=C/C1=CC=C[C@H]([C@@H]1[C@H]2C=CC=C[C+]2/C=C/C)[C@H](C)C[C+:11]3C=CC=C[CH:10]3[C:20]4(C=CC=C[C@@H]4[C@H]5[C@@H](C=CC=C5/C=C/C)[C@H](C)Cc6ccccc6)/C=C/C 10,11=10,20

Priority: 2000

C/C=C/C1=CC=C[C@H]([C@@H]1[C@H]2C=CC=C[C+:20]2/C=C/C)[C@H](C)Cc3ccccc3.C/C=C/C1=CC=C[C@H]([C@@H]1[C@H]2C=CC=C[C+]2/C=C/C)[C@H](C)CC3=C[CH:10]=[CH:11]C=C3>>C/C=C/C1=CC=C[C@H]([C@@H]1[C@H]2C=CC=C[C+]2/C=C/C)[C@H](C)CC3=C[CH:10]([CH+:11]C=C3)[C:20]4(C=CC=C[C@@H]4[C@H]5[C@@H](C=CC=C5/C=C/C)[C@H](C)Cc6ccccc6)/C=C/C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C/C=C/C1=CC=C[C@H]([C@@H]1[C@H]2C=CC=C[C+:20]2/C=C/C)[C@H](C)Cc3ccccc3.C/C=C/C1=CC=C[C@H]([C@@H]1[C@H]2C=CC=C[C+]2/C=C/C)[C@H](C)CC3=C[CH:10]=[CH:11]C=C3>>C/C=C/C1=CC=C[C@H]([C@@H]1[C@H]2C=CC=C[C+]2/C=C/C)[C@H](C)CC3=C[CH:10]([CH+:11]C=C3)[C:20]4(C=CC=C[C@@H]4[C@H]5[C@@H](C=CC=C5/C=C/C)[C@H](C)Cc6ccccc6)/C=C/C 10,11=10,20

Reagent: 26
Reactant Smiles: c1cc2c(c(c1)Br)[CH+][C@@H](C=C2)S(=O)(=O)O.C1=CC(=C2[CH+][C@@H](C=CC2=C1)S(=O)(=O)O)Br
Highest priority first:

Priority: 2500

c1cc2c(c(c1)Br)[CH+:20][C@@H](C=C2)S(=O)(=O)O.C1=CC(=C2[CH+][C@@H](C=C[C:11]2=[CH:10]1)S(=O)(=O)O)Br>>c1cc2c(c(c1)Br)[CH:20]([C@@H](C=C2)S(=O)(=O)O)[CH:10]3C=CC(=C4[C+:11]3C=C[C@H]([CH+]4)S(=O)(=O)O)Br
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C c1cc2c(c(c1)Br)[CH+:20][C@@H](C=C2)S(=O)(=O)O.C1=CC(=C2[CH+][C@@H](C=C[C:11]2=[CH:10]1)S(=O)(=O)O)Br>>c1cc2c(c(c1)Br)[CH:20]([C@@H](C=C2)S(=O)(=O)O)[CH:10]3C=CC(=C4[C+:11]3C=C[C@H]([CH+]4)S(=O)(=O)O)Br 10,11=10,20

Priority: 2000

c1cc2c(c(c1)Br)[CH+:20][C@@H](C=C2)S(=O)(=O)O.[CH:10]1=[CH:11]C(=C2[CH+][C@@H](C=CC2=C1)S(=O)(=O)O)Br>>c1cc2c(c(c1)Br)[CH:20]([C@@H](C=C2)S(=O)(=O)O)[CH:10]3C=C4C=C[C@H]([CH+]C4=C([CH+:11]3)Br)S(=O)(=O)O
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C c1cc2c(c(c1)Br)[CH+:20][C@@H](C=C2)S(=O)(=O)O.[CH:10]1=[CH:11]C(=C2[CH+][C@@H](C=CC2=C1)S(=O)(=O)O)Br>>c1cc2c(c(c1)Br)[CH:20]([C@@H](C=C2)S(=O)(=O)O)[CH:10]3C=C4C=C[C@H]([CH+]C4=C([CH+:11]3)Br)S(=O)(=O)O 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2cccc(c2=C[C@@H]1[C@H]3C=Cc4cccc(c4[CH+]3)C(F)(F)F)C(F)(F)F.CC(C)[C@@H]1C=c2cccc(c2=C[C@@H]1[C@H]3C=CC4=C([CH+]3)C(=CC=C4)C(F)(F)F)C(F)(F)F
Highest priority first:

Priority: 2500

CC(C)[C@@H]1C=c2cccc(c2=C[C@@H]1[C@H]3C=Cc4cccc(c4[CH+:20]3)C(F)(F)F)C(F)(F)F.CC(C)[C@@H]1C=c2cccc(c2=C[C@@H]1[C@H]3C=C[C:12]4=[C:13]([CH+]3)C(=C[CH:10]=[CH:11]4)C(F)(F)F)C(F)(F)F>>CC(C)[C@@H]1C=c2cccc(c2=C[C@@H]1[C@H]3C=C[C:12]4=[CH:11][CH:10](C=C([C+:13]4[CH+]3)C(F)(F)F)[CH:20]5c6c(cccc6C(F)(F)F)C=C[C@@H]5[C@H]7C=c8c(=C[C@H]7C(C)C)cccc8C(F)(F)F)C(F)(F)F
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(C)[C@@H]1C=c2cccc(c2=C[C@@H]1[C@H]3C=Cc4cccc(c4[CH+:20]3)C(F)(F)F)C(F)(F)F.CC(C)[C@@H]1C=c2cccc(c2=C[C@@H]1[C@H]3C=C[C:12]4=[C:13]([CH+]3)C(=C[CH:10]=[CH:11]4)C(F)(F)F)C(F)(F)F>>CC(C)[C@@H]1C=c2cccc(c2=C[C@@H]1[C@H]3C=C[C:12]4=[CH:11][CH:10](C=C([C+:13]4[CH+]3)C(F)(F)F)[CH:20]5c6c(cccc6C(F)(F)F)C=C[C@@H]5[C@H]7C=c8c(=C[C@H]7C(C)C)cccc8C(F)(F)F)C(F)(F)F 10,11=10,20;12,13=11,12

Priority: 2000

CC(C)[C@@H]1C=c2cccc(c2=C[C@@H]1[C@H]3C=Cc4cccc(c4[CH+:20]3)C(F)(F)F)C(F)(F)F.CC(C)[C@@H]1C=c2cccc(c2=C[C@@H]1[C@H]3C=CC4=C([CH+]3)[C:11](=[CH:10]C=C4)C(F)(F)F)C(F)(F)F>>CC(C)[C@@H]1C=c2cccc(c2=C[C@@H]1[C@H]3C=CC4=C([CH+]3)[C+:11]([CH:10](C=C4)[CH:20]5c6c(cccc6C(F)(F)F)C=C[C@@H]5[C@H]7C=c8c(=C[C@H]7C(C)C)cccc8C(F)(F)F)C(F)(F)F)C(F)(F)F
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2cccc(c2=C[C@@H]1[C@H]3C=Cc4cccc(c4[CH+:20]3)C(F)(F)F)C(F)(F)F.CC(C)[C@@H]1C=c2cccc(c2=C[C@@H]1[C@H]3C=CC4=C([CH+]3)[C:11](=[CH:10]C=C4)C(F)(F)F)C(F)(F)F>>CC(C)[C@@H]1C=c2cccc(c2=C[C@@H]1[C@H]3C=CC4=C([CH+]3)[C+:11]([CH:10](C=C4)[CH:20]5c6c(cccc6C(F)(F)F)C=C[C@@H]5[C@H]7C=c8c(=C[C@H]7C(C)C)cccc8C(F)(F)F)C(F)(F)F)C(F)(F)F 10,11=10,20

Reagent: 20
Reactant Smiles: Cc1ccc(cc1)S(=O)(=O)O[C@H](C)CCO(P(Br)Br)P(Br)Br.[Br-]
Highest priority first:

Priority: 6050

Cc1ccc(cc1)S(=O)(=O)[O:21][C@H:20](C)CCO(P(Br)Br)P(Br)Br.[Br-:10]>>Cc1ccc(cc1)S(=O)(=O)[O-:21].C[C@@H:20](CCO(P(Br)Br)P(Br)Br)[Br:10]
( 1 sp3 None 2 4 sigma 5 2 )
n_Br > σ^*_C-O Cc1ccc(cc1)S(=O)(=O)[O:21][C@H:20](C)CCO(P(Br)Br)P(Br)Br.[Br-:10]>>Cc1ccc(cc1)S(=O)(=O)[O-:21].C[C@@H:20](CCO(P(Br)Br)P(Br)Br)[Br:10] 10=20;20,21=21

Priority: 6000

Cc1ccc(cc1)S(=O)(=O)O[C@H](C)C[CH2:20][O:21](P(Br)Br)P(Br)Br.[Br-:10]>>Cc1ccc(cc1)S(=O)(=O)O[C@H](C)C[CH2:20][Br:10].[O-:21](P(Br)Br)P(Br)Br
( 1 sp3 None 2 4 sigma 5 2 )
n_Br > σ^*_C-O Cc1ccc(cc1)S(=O)(=O)O[C@H](C)C[CH2:20][O:21](P(Br)Br)P(Br)Br.[Br-:10]>>Cc1ccc(cc1)S(=O)(=O)O[C@H](C)C[CH2:20][Br:10].[O-:21](P(Br)Br)P(Br)Br 10=20;20,21=21

Reagent: 3
Reactant Smiles: C=C(c1ccccc1)[C@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH+]3)C#C)C#C.C#CC1=CC=CC=C1
Highest priority first:

Priority: 2500

C=C(c1ccccc1)[C@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH+:20]3)C#C)C#C.C#C[C:11]1=[CH:10]C=CC=C1>>C=C(c1ccccc1)[C@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH:20]3[CH:10]4C=CC=C[C+:11]4C#C)C#C)C#C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C=C(c1ccccc1)[C@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH+:20]3)C#C)C#C.C#C[C:11]1=[CH:10]C=CC=C1>>C=C(c1ccccc1)[C@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH:20]3[CH:10]4C=CC=C[C+:11]4C#C)C#C)C#C 10,11=10,20

Priority: 2000

C=C(c1ccccc1)[C@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH+:20]3)C#C)C#C.C#CC1=C[CH:10]=[CH:11]C=C1>>C=C(c1ccccc1)[C@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)C#C)C#C)C#C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C=C(c1ccccc1)[C@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH+:20]3)C#C)C#C.C#CC1=C[CH:10]=[CH:11]C=C1>>C=C(c1ccccc1)[C@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)C#C)C#C)C#C 10,11=10,20

Reagent: 87
Reactant Smiles: [1H]C(C(=O)Cc1ccccc1)C(=O)O[C@](CC(=O)Cc2ccccc2)(OC(=O)c3ccccc3)O[C@](c4ccccc4)([OH2+])[O-].[OH-]
Highest priority first:

Priority: 4424

[H:20][CH:21]([C:22](=[O:23])Cc1ccccc1)C(=O)O[C@](CC(=O)Cc2ccccc2)(OC(=O)c3ccccc3)O[C@](c4ccccc4)([OH2+])[O-].[OH-:10]>>[H:20][OH:10].c1ccc(cc1)CC(=O)C[C@@](OC(=O)[CH:21]=[C:22](Cc2ccccc2)[O-:23])(OC(=O)c3ccccc3)O[C@](c4ccccc4)([OH2+])[O-]
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH:21]([C:22](=[O:23])Cc1ccccc1)C(=O)O[C@](CC(=O)Cc2ccccc2)(OC(=O)c3ccccc3)O[C@](c4ccccc4)([OH2+])[O-].[OH-:10]>>[H:20][OH:10].c1ccc(cc1)CC(=O)C[C@@](OC(=O)[CH:21]=[C:22](Cc2ccccc2)[O-:23])(OC(=O)c3ccccc3)O[C@](c4ccccc4)([OH2+])[O-] 10=20;20,21=21,22;22,23=23

Priority: 4420

[H:20][CH:21](C(=O)Cc1ccccc1)C(=O)O[C@](CC(=O)Cc2ccccc2)(OC(=O)c3ccccc3)O[C@](c4ccccc4)([OH2+])[O-].[OH-:10]>>[H:20][OH:10].c1ccc(cc1)CC(=O)C[C@@](OC(=O)[CH-:21]C(=O)Cc2ccccc2)(OC(=O)c3ccccc3)O[C@](c4ccccc4)([OH2+])[O-]
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH:21](C(=O)Cc1ccccc1)C(=O)O[C@](CC(=O)Cc2ccccc2)(OC(=O)c3ccccc3)O[C@](c4ccccc4)([OH2+])[O-].[OH-:10]>>[H:20][OH:10].c1ccc(cc1)CC(=O)C[C@@](OC(=O)[CH-:21]C(=O)Cc2ccccc2)(OC(=O)c3ccccc3)O[C@](c4ccccc4)([OH2+])[O-] 10=20;20,21=21

Reagent: 16
Reactant Smiles: C[C@@]12CC(=O)[C@H]([C@@](O1)(C[C@](O2)(C)[O-])Cc3ccccc3)c4ccccc4
Highest priority first:

Priority: 6974

C[C@@]12CC(=O)[C@H]([C@@](O1)(C[C@:20]([O:21]2)(C)[O-:10])Cc3ccccc3)c4ccccc4>>C[C@:20](=[O:10])C[C@]1([C@@H](C(=O)C[C@@](O1)(C)[O-:21])c2ccccc2)Cc3ccccc3
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O C[C@@]12CC(=O)[C@H]([C@@](O1)(C[C@:20]([O:21]2)(C)[O-:10])Cc3ccccc3)c4ccccc4>>C[C@:20](=[O:10])C[C@]1([C@@H](C(=O)C[C@@](O1)(C)[O-:21])c2ccccc2)Cc3ccccc3 10=20;20,21=21

Priority: 4446

C[C@@]12C[C:20](=[O:21])[C@H]([C@@](O1)(C[C@](O2)(C)[O-:10])Cc3ccccc3)c4ccccc4>>C[C@@]12C[C@]3([C@@H]([C:20]([O:10]1)(C[C@@](O2)(O3)C)[O-:21])c4ccccc4)Cc5ccccc5
( 5 sp3 None 2 1 pi 2 2 )
n_O > π^*_C=O C[C@@]12C[C:20](=[O:21])[C@H]([C@@](O1)(C[C@](O2)(C)[O-:10])Cc3ccccc3)c4ccccc4>>C[C@@]12C[C@]3([C@@H]([C:20]([O:10]1)(C[C@@](O2)(O3)C)[O-:21])c4ccccc4)Cc5ccccc5 10=20;20,21=21

Reagent: 8
Reactant Smiles: C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=CC=C4)N(C)C.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Priority: 2955

C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C:11]4=[CH:10]C=CC=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C:11]4=[CH:10]C=CC=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=C[CH:10]=[CH:11]4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=C[CH:10]=[CH:11]4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=C[CH:10]=[CH:11]C=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=C[CH:10]=[CH:11]C=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@H]1/N=N/[C+]2C=CC=C[C@@H]2/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-] 10,11=10,20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=C(C=C2[C@@]1(C=CC=C2)[C@H]3C=CC=C4[C+]3C=C(C=C4)S(=O)(=O)O)S(=O)(=O)O
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[C:10](C=C2[C@@]1(C=CC=C2)[C@H]3C=CC=C4[C+:20]3C=C(C=C4)S(=O)(=O)O)S(=O)(=O)O>>CC(C)[C@H]1[CH+:11][C:10]2(C=C3[C@@]1(C=CC=C3)[C@@H]4[C:20]25C=C(C=CC5=CC=C4)S(=O)(=O)O)S(=O)(=O)O
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[C:10](C=C2[C@@]1(C=CC=C2)[C@H]3C=CC=C4[C+:20]3C=C(C=C4)S(=O)(=O)O)S(=O)(=O)O>>CC(C)[C@H]1[CH+:11][C:10]2(C=C3[C@@]1(C=CC=C3)[C@@H]4[C:20]25C=C(C=CC5=CC=C4)S(=O)(=O)O)S(=O)(=O)O 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=C(C=C2[C@@]1([CH:11]=[CH:10]C=C2)[C@H]3C=CC=C4[C+:20]3C=C(C=C4)S(=O)(=O)O)S(=O)(=O)O>>CC(C)[C@H]1C=C(C=C2[C@]13[CH+:11][CH:10](C=C2)[C:20]45[C@@H]3C=CC=C4C=CC(=C5)S(=O)(=O)O)S(=O)(=O)O
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=C(C=C2[C@@]1([CH:11]=[CH:10]C=C2)[C@H]3C=CC=C4[C+:20]3C=C(C=C4)S(=O)(=O)O)S(=O)(=O)O>>CC(C)[C@H]1C=C(C=C2[C@]13[CH+:11][CH:10](C=C2)[C:20]45[C@@H]3C=CC=C4C=CC(=C5)S(=O)(=O)O)S(=O)(=O)O 10,11=10,20

Reagent: 8
Reactant Smiles: C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/C4=CC=CC=C4)N(C)C.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Priority: 2955

C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/[C:11]4=[CH:10]C=CC=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/[C:11]4=[CH:10]C=CC=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/C4=CC=C[CH:10]=[CH:11]4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/C4=CC=C[CH:10]=[CH:11]4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/C4=C[CH:10]=[CH:11]C=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/C4=C[CH:10]=[CH:11]C=C4)N(C)C.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>C[C+]1C=CC(=C[C@@H]1/N=N/[C+]2C=CC=C[C@H]2/N=N/[C+]3C=CC=C[C@H]3/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5)N(C)C.[Cl-] 10,11=10,20;20,21=21

Reagent: 3
Reactant Smiles: CC(C)[C@@H]1[C@H]2C=CC=C[C@]2([C@H]3[C+]1C=CC=C3)C=C(C)C.CC(=CC1=CC=CC=C1)C
Highest priority first:

Priority: 2500

CC(C)[C@@H]1[C@H]2C=CC=C[C@]2([C@H]3[C+:20]1C=CC=C3)C=C(C)C.CC(=C[C:11]1=[CH:10]C=CC=C1)C>>CC(C)[C@@H]1[C@H]2C=CC=C[C@]2([C@H]3[C:20]1(C=CC=C3)[CH:10]4C=CC=C[C+:11]4C=C(C)C)C=C(C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[C@H]2C=CC=C[C@]2([C@H]3[C+:20]1C=CC=C3)C=C(C)C.CC(=C[C:11]1=[CH:10]C=CC=C1)C>>CC(C)[C@@H]1[C@H]2C=CC=C[C@]2([C@H]3[C:20]1(C=CC=C3)[CH:10]4C=CC=C[C+:11]4C=C(C)C)C=C(C)C 10,11=10,20

Priority: 2000

CC(C)[C@@H]1[C@H]2C=CC=C[C@]2([C@H]3[C+:20]1C=CC=C3)C=C(C)C.CC(=CC1=C[CH:10]=[CH:11]C=C1)C>>CC(C)[C@@H]1[C@H]2C=CC=C[C@]2([C@H]3[C:20]1(C=CC=C3)[CH:10]4C=C(C=C[CH+:11]4)C=C(C)C)C=C(C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[C@H]2C=CC=C[C@]2([C@H]3[C+:20]1C=CC=C3)C=C(C)C.CC(=CC1=C[CH:10]=[CH:11]C=C1)C>>CC(C)[C@@H]1[C@H]2C=CC=C[C@]2([C@H]3[C:20]1(C=CC=C3)[CH:10]4C=C(C=C[CH+:11]4)C=C(C)C)C=C(C)C 10,11=10,20

Reagent: 3
Reactant Smiles: CC(C)[C@H]1C=C(C=C[C@H]1[C@@H]2C=CC(=C[CH+]2)Br)Br
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[C:10](C=C[C@H]1[C@@H]2C=CC(=C[CH+:20]2)Br)Br>>CC(C)[C@H]1[CH+:11][C:10]2(C=C[C@H]1[C@H]3[CH:20]2C=C(C=C3)Br)Br
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[C:10](C=C[C@H]1[C@@H]2C=CC(=C[CH+:20]2)Br)Br>>CC(C)[C@H]1[CH+:11][C:10]2(C=C[C@H]1[C@H]3[CH:20]2C=C(C=C3)Br)Br 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=C([CH:10]=[CH:11][C@H]1[C@@H]2C=CC(=C[CH+:20]2)Br)Br>>CC(C)[C@H]1C=C([CH:10]2[CH+:11][C@H]1[C@H]3[CH:20]2C=C(C=C3)Br)Br
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=C([CH:10]=[CH:11][C@H]1[C@@H]2C=CC(=C[CH+:20]2)Br)Br>>CC(C)[C@H]1C=C([CH:10]2[CH+:11][C@H]1[C@H]3[CH:20]2C=C(C=C3)Br)Br 10,11=10,20

Priority: 7030

CC(C)[C@H]1C=C(C=C[C@H]1[C@@H]2C=C[C:11](=[CH:10][CH+:20]2)Br)Br>>CC(C)[C@H]1C=C(C=C[C@H]1[C@@H]2C=C[C+:11]([CH:10]=[CH:20]2)Br)Br
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=C(C=C[C@H]1[C@@H]2C=C[C:11](=[CH:10][CH+:20]2)Br)Br>>CC(C)[C@H]1C=C(C=C[C@H]1[C@@H]2C=C[C+:11]([CH:10]=[CH:20]2)Br)Br 10,11=10,20

Reagent: 3
Reactant Smiles: C[C@H](Cc1ccccc1)[C@@H]2C=C(C=C[C@@H]2[C@@H]3C=C(C=C[CH+]3)CC=C)CC=C.C[C@H](CC1=CC=CC=C1)[C@@H]2C=C(C=C[C@@H]2[C@@H]3C=C(C=C[CH+]3)CC=C)CC=C
Highest priority first:

Priority: 2500

C[C@H](Cc1ccccc1)[C@@H]2C=C(C=C[C@@H]2[C@@H]3C=C(C=C[CH+:20]3)CC=C)CC=C.C[C@H](C[C:11]1=[CH:10]C=CC=C1)[C@@H]2C=C(C=C[C@@H]2[C@@H]3C=C(C=C[CH+]3)CC=C)CC=C>>C[C@H](Cc1ccccc1)[C@@H]2C=C(C=C[C@@H]2[C@@H]3C=C(C=C[CH:20]3[CH:10]4C=CC=C[C+:11]4C[C@@H](C)[C@@H]5C=C(C=C[C@@H]5[C@@H]6C=C(C=C[CH+]6)CC=C)CC=C)CC=C)CC=C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C@H](Cc1ccccc1)[C@@H]2C=C(C=C[C@@H]2[C@@H]3C=C(C=C[CH+:20]3)CC=C)CC=C.C[C@H](C[C:11]1=[CH:10]C=CC=C1)[C@@H]2C=C(C=C[C@@H]2[C@@H]3C=C(C=C[CH+]3)CC=C)CC=C>>C[C@H](Cc1ccccc1)[C@@H]2C=C(C=C[C@@H]2[C@@H]3C=C(C=C[CH:20]3[CH:10]4C=CC=C[C+:11]4C[C@@H](C)[C@@H]5C=C(C=C[C@@H]5[C@@H]6C=C(C=C[CH+]6)CC=C)CC=C)CC=C)CC=C 10,11=10,20

Priority: 2000

C[C@H](Cc1ccccc1)[C@@H]2C=C(C=C[C@@H]2[C@@H]3C=C(C=C[CH+:20]3)CC=C)CC=C.C[C@H](CC1=C[CH:10]=[CH:11]C=C1)[C@@H]2C=C(C=C[C@@H]2[C@@H]3C=C(C=C[CH+]3)CC=C)CC=C>>C[C@H](Cc1ccccc1)[C@@H]2C=C(C=C[C@@H]2[C@@H]3C=C(C=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)C[C@@H](C)[C@@H]5C=C(C=C[C@@H]5[C@@H]6C=C(C=C[CH+]6)CC=C)CC=C)CC=C)CC=C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C@H](Cc1ccccc1)[C@@H]2C=C(C=C[C@@H]2[C@@H]3C=C(C=C[CH+:20]3)CC=C)CC=C.C[C@H](CC1=C[CH:10]=[CH:11]C=C1)[C@@H]2C=C(C=C[C@@H]2[C@@H]3C=C(C=C[CH+]3)CC=C)CC=C>>C[C@H](Cc1ccccc1)[C@@H]2C=C(C=C[C@@H]2[C@@H]3C=C(C=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)C[C@@H](C)[C@@H]5C=C(C=C[C@@H]5[C@@H]6C=C(C=C[CH+]6)CC=C)CC=C)CC=C)CC=C 10,11=10,20

Reagent: 66
Reactant Smiles: CC1=CC=CC2=CC=C[C@H]([C+]12)[C@]34[C@H](C=CC=C3C=CC=C4C)C(C)C
Highest priority first:

Priority: 7084

CC1=CC=CC2=CC=C[C@H]([C+:20]12)[C@]34[C@H]([CH:11]=[CH:10]C=C3C=CC=C4C)C(C)C>>CC1=CC=CC2=CC=C[C@@H]3[C:20]12[CH:10]4C=C5[C@]3([C@H]([CH+:11]4)C(C)C)C(=CC=C5)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC1=CC=CC2=CC=C[C@H]([C+:20]12)[C@]34[C@H]([CH:11]=[CH:10]C=C3C=CC=C4C)C(C)C>>CC1=CC=CC2=CC=C[C@@H]3[C:20]12[CH:10]4C=C5[C@]3([C@H]([CH+:11]4)C(C)C)C(=CC=C5)C 10,11=10,20

Priority: 7082

CC1=CC=CC2=CC=C[C@H]([C+:20]12)[C@]34[C@H](C=CC=C3C=C[CH:10]=[C:11]4C)C(C)C>>CC1=CC=CC2=CC=C[C@@H]3[C:20]12[CH:10]4C=CC5=CC=C[C@@H]([C@@]35[C+:11]4C)C(C)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC1=CC=CC2=CC=C[C@H]([C+:20]12)[C@]34[C@H](C=CC=C3C=C[CH:10]=[C:11]4C)C(C)C>>CC1=CC=CC2=CC=C[C@@H]3[C:20]12[CH:10]4C=CC5=CC=C[C@@H]([C@@]35[C+:11]4C)C(C)C 10,11=10,20

Reagent: 3
Reactant Smiles: C/C=C/C1=C[C@H]([C@H](C=C1)[C@H]2C=CC=C([CH+]2)/C=C/C)[C@@H](C)Cc3ccccc3.C/C=C/C1=C[C@H]([C@H](C=C1)[C@H]2C=CC=C([CH+]2)/C=C/C)[C@@H](C)CC3=CC=CC=C3
Highest priority first:

Priority: 2500

C/C=C/C1=C[C@H]([C@H](C=C1)[C@H]2C=CC=C([CH+:20]2)/C=C/C)[C@@H](C)Cc3ccccc3.C/C=C/C1=C[C@H]([C@H](C=C1)[C@H]2C=CC=C([CH+]2)/C=C/C)[C@@H](C)C[C:11]3=[CH:10]C=CC=C3>>C/C=C/C1=C[C@H]([C@H](C=C1)[C@H]2C=CC=C([CH+]2)/C=C/C)[C@@H](C)C[C+:11]3C=CC=C[CH:10]3[CH:20]4[C@H](C=CC=C4/C=C/C)[C@H]5C=CC(=C[C@H]5[C@@H](C)Cc6ccccc6)/C=C/C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C/C=C/C1=C[C@H]([C@H](C=C1)[C@H]2C=CC=C([CH+:20]2)/C=C/C)[C@@H](C)Cc3ccccc3.C/C=C/C1=C[C@H]([C@H](C=C1)[C@H]2C=CC=C([CH+]2)/C=C/C)[C@@H](C)C[C:11]3=[CH:10]C=CC=C3>>C/C=C/C1=C[C@H]([C@H](C=C1)[C@H]2C=CC=C([CH+]2)/C=C/C)[C@@H](C)C[C+:11]3C=CC=C[CH:10]3[CH:20]4[C@H](C=CC=C4/C=C/C)[C@H]5C=CC(=C[C@H]5[C@@H](C)Cc6ccccc6)/C=C/C 10,11=10,20

Priority: 2000

C/C=C/C1=C[C@H]([C@H](C=C1)[C@H]2C=CC=C([CH+:20]2)/C=C/C)[C@@H](C)Cc3ccccc3.C/C=C/C1=C[C@H]([C@H](C=C1)[C@H]2C=CC=C([CH+]2)/C=C/C)[C@@H](C)CC3=C[CH:10]=[CH:11]C=C3>>C/C=C/C1=C[C@H]([C@H](C=C1)[C@H]2C=CC=C([CH+]2)/C=C/C)[C@@H](C)CC3=C[CH:10]([CH+:11]C=C3)[CH:20]4[C@H](C=CC=C4/C=C/C)[C@H]5C=CC(=C[C@H]5[C@@H](C)Cc6ccccc6)/C=C/C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C/C=C/C1=C[C@H]([C@H](C=C1)[C@H]2C=CC=C([CH+:20]2)/C=C/C)[C@@H](C)Cc3ccccc3.C/C=C/C1=C[C@H]([C@H](C=C1)[C@H]2C=CC=C([CH+]2)/C=C/C)[C@@H](C)CC3=C[CH:10]=[CH:11]C=C3>>C/C=C/C1=C[C@H]([C@H](C=C1)[C@H]2C=CC=C([CH+]2)/C=C/C)[C@@H](C)CC3=C[CH:10]([CH+:11]C=C3)[CH:20]4[C@H](C=CC=C4/C=C/C)[C@H]5C=CC(=C[C@H]5[C@@H](C)Cc6ccccc6)/C=C/C 10,11=10,20

Reagent: 3
Reactant Smiles: COC[C@H](c1ccccc1)[C@H]2C=CC=C[C@@]2(/C=C/OC)[C@H]3C=C(C=C[CH+]3)/C=C/OC.COC[C@@H]([C@H]1C=CC=C[C@@]1(/C=C/OC)[C@H]2C=C(C=C[CH+]2)/C=C/OC)C3=CC=CC=C3
Highest priority first:

Priority: 2500

COC[C@H](c1ccccc1)[C@H]2C=CC=C[C@@]2(/C=C/OC)[C@H]3C=C(C=C[CH+:20]3)/C=C/OC.COC[C@@H]([C@H]1C=CC=C[C@@]1(/C=C/OC)[C@H]2C=C(C=C[CH+]2)/C=C/OC)[C:13]3=[CH:12][CH:11]=[CH:10]C=C3>>COC[C@H](c1ccccc1)[C@H]2C=CC=C[C@@]2(/C=C/OC)[C@H]3C=C(C=C[CH:20]3[CH:10]4[CH:11]=[CH:12][C+:13](C=C4)[C@@H](COC)[C@H]5C=CC=C[C@@]5(/C=C/OC)[C@H]6C=C(C=C[CH+]6)/C=C/OC)/C=C/OC
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C COC[C@H](c1ccccc1)[C@H]2C=CC=C[C@@]2(/C=C/OC)[C@H]3C=C(C=C[CH+:20]3)/C=C/OC.COC[C@@H]([C@H]1C=CC=C[C@@]1(/C=C/OC)[C@H]2C=C(C=C[CH+]2)/C=C/OC)[C:13]3=[CH:12][CH:11]=[CH:10]C=C3>>COC[C@H](c1ccccc1)[C@H]2C=CC=C[C@@]2(/C=C/OC)[C@H]3C=C(C=C[CH:20]3[CH:10]4[CH:11]=[CH:12][C+:13](C=C4)[C@@H](COC)[C@H]5C=CC=C[C@@]5(/C=C/OC)[C@H]6C=C(C=C[CH+]6)/C=C/OC)/C=C/OC 10,11=10,20;12,13=11,12

Priority: 2000

COC[C@H](c1ccccc1)[C@H]2C=CC=C[C@@]2(/C=C/OC)[C@H]3C=C(C=C[CH+:20]3)/C=C/OC.COC[C@@H]([C@H]1C=CC=C[C@@]1(/C=C/OC)[C@H]2C=C(C=C[CH+]2)/C=C/OC)C3=C[CH:10]=[CH:11]C=C3>>COC[C@H](c1ccccc1)[C@H]2C=CC=C[C@@]2(/C=C/OC)[C@H]3C=C(C=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)[C@@H](COC)[C@H]5C=CC=C[C@@]5(/C=C/OC)[C@H]6C=C(C=C[CH+]6)/C=C/OC)/C=C/OC
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C COC[C@H](c1ccccc1)[C@H]2C=CC=C[C@@]2(/C=C/OC)[C@H]3C=C(C=C[CH+:20]3)/C=C/OC.COC[C@@H]([C@H]1C=CC=C[C@@]1(/C=C/OC)[C@H]2C=C(C=C[CH+]2)/C=C/OC)C3=C[CH:10]=[CH:11]C=C3>>COC[C@H](c1ccccc1)[C@H]2C=CC=C[C@@]2(/C=C/OC)[C@H]3C=C(C=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)[C@@H](COC)[C@H]5C=CC=C[C@@]5(/C=C/OC)[C@H]6C=C(C=C[CH+]6)/C=C/OC)/C=C/OC 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=CC=C2[C@@]1(C=CC(=C2)[N+](=O)[O-])[C@@H]3C=CC=C4[C+]3C=CC(=C4)[N+](=O)[O-]
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[CH:10]C=C2[C@@]1(C=CC(=C2)[N+](=O)[O-])[C@@H]3C=CC=C4[C+:20]3C=CC(=C4)[N+](=O)[O-]>>CC(C)[C@H]1[CH+:11][CH:10]2C=C3[C@@]1(C=CC(=C3)[N+](=O)[O-])[C@H]4[C:20]25C=CC(=CC5=CC=C4)[N+](=O)[O-]
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[CH:10]C=C2[C@@]1(C=CC(=C2)[N+](=O)[O-])[C@@H]3C=CC=C4[C+:20]3C=CC(=C4)[N+](=O)[O-]>>CC(C)[C@H]1[CH+:11][CH:10]2C=C3[C@@]1(C=CC(=C3)[N+](=O)[O-])[C@H]4[C:20]25C=CC(=CC5=CC=C4)[N+](=O)[O-] 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=CC=C2[C@@]1([CH:11]=[CH:10]C(=C2)[N+](=O)[O-])[C@@H]3C=CC=C4[C+:20]3C=CC(=C4)[N+](=O)[O-]>>CC(C)[C@H]1C=CC=C2[C@]13[CH+:11][CH:10](C(=C2)[N+](=O)[O-])[C:20]45[C@H]3C=CC=C4C=C(C=C5)[N+](=O)[O-]
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC=C2[C@@]1([CH:11]=[CH:10]C(=C2)[N+](=O)[O-])[C@@H]3C=CC=C4[C+:20]3C=CC(=C4)[N+](=O)[O-]>>CC(C)[C@H]1C=CC=C2[C@]13[CH+:11][CH:10](C(=C2)[N+](=O)[O-])[C:20]45[C@H]3C=CC=C4C=C(C=C5)[N+](=O)[O-] 10,11=10,20

Reagent: 16
Reactant Smiles: CO[C@@]12CC(=O)[C@@H]([C@@](O1)(C[C@](O2)([O-])OC)Cc3ccccc3)c4ccccc4
Highest priority first:

Priority: 6975

CO[C@@]12CC(=O)[C@@H]([C@@](O1)(C[C@:20]([O:21]2)([O-:10])OC)Cc3ccccc3)c4ccccc4>>CO[C@@:20](=[O:10])C[C@]1([C@H](C(=O)C[C@](O1)([O-:21])OC)c2ccccc2)Cc3ccccc3
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CO[C@@]12CC(=O)[C@@H]([C@@](O1)(C[C@:20]([O:21]2)([O-:10])OC)Cc3ccccc3)c4ccccc4>>CO[C@@:20](=[O:10])C[C@]1([C@H](C(=O)C[C@](O1)([O-:21])OC)c2ccccc2)Cc3ccccc3 10=20;20,21=21

Priority: 4446

CO[C@@]12C[C:20](=[O:21])[C@@H]([C@@](O1)(C[C@](O2)([O-:10])OC)Cc3ccccc3)c4ccccc4>>CO[C@]12C[C@]3([C@H]([C:20]([O:10]1)(C[C@](O3)(O2)OC)[O-:21])c4ccccc4)Cc5ccccc5
( 5 sp3 None 2 1 pi 2 2 )
n_O > π^*_C=O CO[C@@]12C[C:20](=[O:21])[C@@H]([C@@](O1)(C[C@](O2)([O-:10])OC)Cc3ccccc3)c4ccccc4>>CO[C@]12C[C@]3([C@H]([C:20]([O:10]1)(C[C@](O3)(O2)OC)[O-:21])c4ccccc4)Cc5ccccc5 10=20;20,21=21

Reagent: 87
Reactant Smiles: [1H][C@](C)(C(=O)C)[C@@](C)(CC)O.[OH-]
Highest priority first:

Priority: 4387

[H:20][C@:21](C)([C:22](=[O:23])C)[C@@](C)(CC)O.[OH-:10]>>[H:20][OH:10].CC[C@](C)([C@:21](=[C:22](C)[O-:23])C)O
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][C@:21](C)([C:22](=[O:23])C)[C@@](C)(CC)O.[OH-:10]>>[H:20][OH:10].CC[C@](C)([C@:21](=[C:22](C)[O-:23])C)O 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][C@:21](C)(C(=O)C)[C@@](C)(CC)O.[OH-:10]>>[H:20][OH:10].CC[C@](C)([C@@-:21](C)C(=O)C)O
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][C@:21](C)(C(=O)C)[C@@](C)(CC)O.[OH-:10]>>[H:20][OH:10].CC[C@](C)([C@@-:21](C)C(=O)C)O 10=20;20,21=21

Reagent: 140
Reactant Smiles: [1H]C(C[C@H]1CCC[C@@H](C1=O)C)C(=O)CC.CC[O-]
Highest priority first:

Priority: 4378

[H:20][CH:21](C[C@H]1CCC[C@@H](C1=O)C)[C:22](=[O:23])CC.CC[O-:10]>>[H:20][O:10]CC.CC[C:22](=[CH:21]C[C@H]1CCC[C@@H](C1=O)C)[O-:23]
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH:21](C[C@H]1CCC[C@@H](C1=O)C)[C:22](=[O:23])CC.CC[O-:10]>>[H:20][O:10]CC.CC[C:22](=[CH:21]C[C@H]1CCC[C@@H](C1=O)C)[O-:23] 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][CH:21](C[C@H]1CCC[C@@H](C1=O)C)C(=O)CC.CC[O-:10]>>[H:20][O:10]CC.CCC(=O)[CH-:21]C[C@H]1CCC[C@@H](C1=O)C
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH:21](C[C@H]1CCC[C@@H](C1=O)C)C(=O)CC.CC[O-:10]>>[H:20][O:10]CC.CCC(=O)[CH-:21]C[C@H]1CCC[C@@H](C1=O)C 10=20;20,21=21

Reagent: 27
Reactant Smiles: C[C@@](O)([O-])[OH+][C@H]([OH2+])O
Highest priority first:

Priority: 6975

C[C@@:20]([OH:21])([O-:10])[OH+][C@H]([OH2+])O>>C[C@@:20](=[O:10])[OH+][C@H]([OH2+])O.[OH-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O C[C@@:20]([OH:21])([O-:10])[OH+][C@H]([OH2+])O>>C[C@@:20](=[O:10])[OH+][C@H]([OH2+])O.[OH-:21] 10=20;20,21=21

Priority: 6973

C[C@@:20]([OH:10])([O-])[OH+:21][C@H]([OH2+])O>>C[C@:20](=[OH+:10])[O-].[C@H]([OH2+])([OH:21])O
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-O C[C@@:20]([OH:10])([O-])[OH+:21][C@H]([OH2+])O>>C[C@:20](=[OH+:10])[O-].[C@H]([OH2+])([OH:21])O 10=20;20,21=21

Priority: 4100

C[C@@](O)([O-])[OH+][C@H:20]([OH2+:21])O>>C[C@@](O)([O-])[OH+][C@@H+:20]O.[OH2:21]
( 1 sigma 2 2 1 sigma 2 2 )
σ_C-O > σ^*_C-O C[C@@](O)([O-])[OH+][C@H:20]([OH2+:21])O>>C[C@@](O)([O-])[OH+][C@@H+:20]O.[OH2:21] 20,21=21

Reagent: 140
Reactant Smiles: [1H]CC(=O)C[C@@H](C)CC(=O)/C=C/C.CC[O-]
Highest priority first:

Priority: 4386

[H:20][CH2:21][C:22](=[O:23])C[C@@H](C)CC(=O)/C=C/C.CC[O-:10]>>[H:20][O:10]CC.C/C=C/C(=O)C[C@H](C)C[C:22](=[CH2:21])[O-:23]
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH2:21][C:22](=[O:23])C[C@@H](C)CC(=O)/C=C/C.CC[O-:10]>>[H:20][O:10]CC.C/C=C/C(=O)C[C@H](C)C[C:22](=[CH2:21])[O-:23] 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][CH2:21]C(=O)C[C@@H](C)CC(=O)/C=C/C.CC[O-:10]>>[H:20][O:10]CC.C/C=C/C(=O)C[C@H](C)CC(=O)[CH2-:21]
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH2:21]C(=O)C[C@@H](C)CC(=O)/C=C/C.CC[O-:10]>>[H:20][O:10]CC.C/C=C/C(=O)C[C@H](C)CC(=O)[CH2-:21] 10=20;20,21=21

Reagent: 87
Reactant Smiles: [1H]C(C(=O)[C@H](c1ccccc1)[C@@](Cc2ccccc2)(CC(=O)N(C)C)O)C(=O)N(C)C.[OH-]
Highest priority first:

Priority: 4424

[H:20][CH:21]([C:22](=[O:23])[C@H](c1ccccc1)[C@@](Cc2ccccc2)(CC(=O)N(C)C)O)C(=O)N(C)C.[OH-:10]>>[H:20][OH:10].CN(C)C(=O)C[C@](Cc1ccccc1)([C@@H](c2ccccc2)[C:22](=[CH:21]C(=O)N(C)C)[O-:23])O
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH:21]([C:22](=[O:23])[C@H](c1ccccc1)[C@@](Cc2ccccc2)(CC(=O)N(C)C)O)C(=O)N(C)C.[OH-:10]>>[H:20][OH:10].CN(C)C(=O)C[C@](Cc1ccccc1)([C@@H](c2ccccc2)[C:22](=[CH:21]C(=O)N(C)C)[O-:23])O 10=20;20,21=21,22;22,23=23

Priority: 4420

[H:20][CH:21](C(=O)[C@H](c1ccccc1)[C@@](Cc2ccccc2)(CC(=O)N(C)C)O)C(=O)N(C)C.[OH-:10]>>[H:20][OH:10].CN(C)C(=O)C[C@](Cc1ccccc1)([C@@H](c2ccccc2)C(=O)[CH-:21]C(=O)N(C)C)O
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH:21](C(=O)[C@H](c1ccccc1)[C@@](Cc2ccccc2)(CC(=O)N(C)C)O)C(=O)N(C)C.[OH-:10]>>[H:20][OH:10].CN(C)C(=O)C[C@](Cc1ccccc1)([C@@H](c2ccccc2)C(=O)[CH-:21]C(=O)N(C)C)O 10=20;20,21=21

Reagent: 3
Reactant Smiles: CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=CC=C([CH+]2)[NH3+])N
Highest priority first:

Priority: 7084

CC(C)[C@@H]1[CH:11]=[C:10](C=C[C@H]1[C@@H]2C=CC=C([CH+:20]2)[NH3+])N>>CC(C)[C@@H]1[CH+:11][C:10]2(C=C[C@H]1[C@H]3[CH:20]2C(=CC=C3)[NH3+])N
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH:11]=[C:10](C=C[C@H]1[C@@H]2C=CC=C([CH+:20]2)[NH3+])N>>CC(C)[C@@H]1[CH+:11][C:10]2(C=C[C@H]1[C@H]3[CH:20]2C(=CC=C3)[NH3+])N 10,11=10,20

Priority: 7082

CC(C)[C@@H]1C=C([CH:10]=[CH:11][C@H]1[C@@H]2C=CC=C([CH+:20]2)[NH3+])N>>CC(C)[C@@H]1C=C([CH:10]2[CH+:11][C@H]1[C@H]3[CH:20]2C(=CC=C3)[NH3+])N
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C([CH:10]=[CH:11][C@H]1[C@@H]2C=CC=C([CH+:20]2)[NH3+])N>>CC(C)[C@@H]1C=C([CH:10]2[CH+:11][C@H]1[C@H]3[CH:20]2C(=CC=C3)[NH3+])N 10,11=10,20

Priority: 7030

CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=C[CH:11]=[C:10]([CH+:20]2)[NH3+])N>>CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=C[CH+:11][C:10](=[CH:20]2)[NH3+])N
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=C[CH:11]=[C:10]([CH+:20]2)[NH3+])N>>CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=C[CH+:11][C:10](=[CH:20]2)[NH3+])N 10,11=10,20

Reagent: 26
Reactant Smiles: C1=CC=C2C(=C1)C=C[C@H]([C+]2C(F)(F)F)S(=O)(=O)O.O[S+](=O)=O
Highest priority first:

Priority: 2500

C1=CC=C2[C:11](=[CH:10]1)C=C[C@H]([C+]2C(F)(F)F)S(=O)(=O)O.O[S+:20](=O)=O>>C1=C[CH:10]([C+:11]2C=C[C@H]([C+](C2=C1)C(F)(F)F)S(=O)(=O)O)[S:20](=O)(=O)O
( 2 pi 1 2 5 p None 0 )
π_C=C > p_S C1=CC=C2[C:11](=[CH:10]1)C=C[C@H]([C+]2C(F)(F)F)S(=O)(=O)O.O[S+:20](=O)=O>>C1=C[CH:10]([C+:11]2C=C[C@H]([C+](C2=C1)C(F)(F)F)S(=O)(=O)O)[S:20](=O)(=O)O 10,11=10,20

Priority: 2000

[CH:10]1=[CH:11]C=C2C(=C1)C=C[C@H]([C+]2C(F)(F)F)S(=O)(=O)O.O[S+:20](=O)=O>>C1=CC2=C[CH:10]([CH+:11]C=C2[C+]([C@@H]1S(=O)(=O)O)C(F)(F)F)[S:20](=O)(=O)O
( 2 pi 1 2 5 p None 0 )
π_C=C > p_S [CH:10]1=[CH:11]C=C2C(=C1)C=C[C@H]([C+]2C(F)(F)F)S(=O)(=O)O.O[S+:20](=O)=O>>C1=CC2=C[CH:10]([CH+:11]C=C2[C+]([C@@H]1S(=O)(=O)O)C(F)(F)F)[S:20](=O)(=O)O 10,11=10,20

Reagent: 66
Reactant Smiles: Cc1ccc2=C[C@@H]([CH+]C=c2c1)[C@]34C=CC=CC3=CC(=C[C@@H]4C(C)C)C
Highest priority first:

Priority: 7084

Cc1ccc2=C[C@@H]([CH+:20]C=c2c1)[C@]34C=CC=CC3=C[C:10](=[CH:11][C@@H]4C(C)C)C>>Cc1ccc2=C[C@H]3[CH:20](C=c2c1)[C:10]4(C=C5[C@]3(C=CC=C5)[C@H]([CH+:11]4)C(C)C)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C Cc1ccc2=C[C@@H]([CH+:20]C=c2c1)[C@]34C=CC=CC3=C[C:10](=[CH:11][C@@H]4C(C)C)C>>Cc1ccc2=C[C@H]3[CH:20](C=c2c1)[C:10]4(C=C5[C@]3(C=CC=C5)[C@H]([CH+:11]4)C(C)C)C 10,11=10,20

Priority: 7082

Cc1ccc2=C[C@@H]([CH+:20]C=c2c1)[C@]34[CH:11]=[CH:10]C=CC3=CC(=C[C@@H]4C(C)C)C>>Cc1ccc2=C[C@H]3[CH:20](C=c2c1)[CH:10]4C=CC5=CC(=C[C@@H]([C@]35[CH+:11]4)C(C)C)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C Cc1ccc2=C[C@@H]([CH+:20]C=c2c1)[C@]34[CH:11]=[CH:10]C=CC3=CC(=C[C@@H]4C(C)C)C>>Cc1ccc2=C[C@H]3[CH:20](C=c2c1)[CH:10]4C=CC5=CC(=C[C@@H]([C@]35[CH+:11]4)C(C)C)C 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=CC=C2[C@@]1(C(=CC=C2)C(=O)C)[C@@H]3C=C(c4ccccc4[CH+]3)C(=O)C
Highest priority first:

Priority: 7084

CC(C)[C@@H]1[CH:11]=[CH:10]C=C2[C@@]1(C(=CC=C2)C(=O)C)[C@@H]3C=C(c4ccccc4[CH+:20]3)C(=O)C>>CC(C)[C@@H]1[CH+:11][CH:10]2C=C3[C@]1([C@H]4[CH:20]2c5ccccc5C(=C4)C(=O)C)C(=CC=C3)C(=O)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH:11]=[CH:10]C=C2[C@@]1(C(=CC=C2)C(=O)C)[C@@H]3C=C(c4ccccc4[CH+:20]3)C(=O)C>>CC(C)[C@@H]1[CH+:11][CH:10]2C=C3[C@]1([C@H]4[CH:20]2c5ccccc5C(=C4)C(=O)C)C(=CC=C3)C(=O)C 10,11=10,20

Priority: 7082

CC(C)[C@@H]1C=CC=C2[C@@]1([C:11](=[CH:10]C=C2)C(=O)C)[C@@H]3C=C(c4ccccc4[CH+:20]3)C(=O)C>>CC(C)[C@@H]1C=CC=C2[C@@]13[C@@H]4C=C(c5ccccc5[CH:20]4[CH:10]([C+:11]3C(=O)C)C=C2)C(=O)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=CC=C2[C@@]1([C:11](=[CH:10]C=C2)C(=O)C)[C@@H]3C=C(c4ccccc4[CH+:20]3)C(=O)C>>CC(C)[C@@H]1C=CC=C2[C@@]13[C@@H]4C=C(c5ccccc5[CH:20]4[CH:10]([C+:11]3C(=O)C)C=C2)C(=O)C 10,11=10,20

Reagent: 3
Reactant Smiles: C[C@@H](c1ccccc1)[C@H]2C=CC=C[C@@]2(C=C)[C@H]3C=CC=C[C+]3C=C
Highest priority first:

Priority: 7084

C[C@@H](c1ccccc1)[C@H]2[CH:11]=[CH:10]C=C[C@@]2(C=C)[C@H]3C=CC=C[C+:20]3C=C>>C[C@@H](c1ccccc1)[C@H]2[CH+:11][CH:10]3C=C[C@]2([C@@H]4[C:20]3(C=CC=C4)C=C)C=C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C C[C@@H](c1ccccc1)[C@H]2[CH:11]=[CH:10]C=C[C@@]2(C=C)[C@H]3C=CC=C[C+:20]3C=C>>C[C@@H](c1ccccc1)[C@H]2[CH+:11][CH:10]3C=C[C@]2([C@@H]4[C:20]3(C=CC=C4)C=C)C=C 10,11=10,20

Priority: 7082

C[C@@H](c1ccccc1)[C@H]2C=CC=C[C@@]2([CH:11]=[CH2:10])[C@H]3C=CC=C[C+:20]3C=C>>C[C@@H](c1ccccc1)[C@H]2C=CC=C[C@]23[CH+:11][CH2:10][C:20]4([C@@H]3C=CC=C4)C=C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C C[C@@H](c1ccccc1)[C@H]2C=CC=C[C@@]2([CH:11]=[CH2:10])[C@H]3C=CC=C[C+:20]3C=C>>C[C@@H](c1ccccc1)[C@H]2C=CC=C[C@]23[CH+:11][CH2:10][C:20]4([C@@H]3C=CC=C4)C=C 10,11=10,20

Priority: 7030

C[C@@H](c1ccccc1)[C@H]2C=CC=C[C@@]2(C=C)[C@H]3C=CC=C[C+:20]3[CH:10]=[CH2:11]>>C[C@@H](c1ccccc1)[C@H]2C=CC=C[C@@]2(C=C)[C@H]3C=CC=C[C:20]3=[CH:10][CH2+:11]
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C C[C@@H](c1ccccc1)[C@H]2C=CC=C[C@@]2(C=C)[C@H]3C=CC=C[C+:20]3[CH:10]=[CH2:11]>>C[C@@H](c1ccccc1)[C@H]2C=CC=C[C@@]2(C=C)[C@H]3C=CC=C[C:20]3=[CH:10][CH2+:11] 10,11=10,20

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C[C+]4O.[Cl-]
Highest priority first:

Priority: 2955

c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@H]5C=CC=C[C+]5O.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@H]5C=CC=C[C+]5O.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@H]5C=CC=C[C+]5O.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@H]5C=CC=C[C+]5O.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@H]5C=CC=C[C+]5O.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@H]5C=CC=C[C+]5O.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@H]5C=CC=C[C+]5O.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C[C+]4O.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4/N=N/[C@H]5C=CC=C[C+]5O.[Cl-] 10,11=10,20;20,21=21

Reagent: 66
Reactant Smiles: CC1=CC2=CC=C[C@@H]([C@]2(C=C1)[C@@H]3C=CC=C4[C+]3C=C(C=C4)C)C(C)C
Highest priority first:

Priority: 7084

C[C:10]1=[CH:11]C2=CC=C[C@@H]([C@]2(C=C1)[C@@H]3C=CC=C4[C+:20]3C=C(C=C4)C)C(C)C>>CC1=C[C:20]23[C@@H](C=CC=C2C=C1)[C@]45C=C[C:10]3([CH+:11]C4=CC=C[C@@H]5C(C)C)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C C[C:10]1=[CH:11]C2=CC=C[C@@H]([C@]2(C=C1)[C@@H]3C=CC=C4[C+:20]3C=C(C=C4)C)C(C)C>>CC1=C[C:20]23[C@@H](C=CC=C2C=C1)[C@]45C=C[C:10]3([CH+:11]C4=CC=C[C@@H]5C(C)C)C 10,11=10,20

Priority: 7082

CC1=CC2=CC=C[C@@H]([C@]2([CH:11]=[CH:10]1)[C@@H]3C=CC=C4[C+:20]3C=C(C=C4)C)C(C)C>>CC1=C[C:20]23[C@@H](C=CC=C2C=C1)[C@]45[CH+:11][CH:10]3C(=CC4=CC=C[C@@H]5C(C)C)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC1=CC2=CC=C[C@@H]([C@]2([CH:11]=[CH:10]1)[C@@H]3C=CC=C4[C+:20]3C=C(C=C4)C)C(C)C>>CC1=C[C:20]23[C@@H](C=CC=C2C=C1)[C@]45[CH+:11][CH:10]3C(=CC4=CC=C[C@@H]5C(C)C)C 10,11=10,20

Reagent: 16
Reactant Smiles: [1H]C1C(=O)C[C@@](O[C@]1(Cc2ccccc2)O)(C)CC(=O)Cc3ccccc3.CC[O-].[Na+]
Highest priority first:

Priority: 4387

[H:20][CH:21]1[C:22](=[O:23])C[C@@](O[C@]1(Cc2ccccc2)O)(C)CC(=O)Cc3ccccc3.CC[O-:10].[Na+]>>[H:20][O:10]CC.C[C@]1(C[C:22](=[CH:21][C@@](O1)(Cc2ccccc2)O)[O-:23])CC(=O)Cc3ccccc3.[Na+]
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH:21]1[C:22](=[O:23])C[C@@](O[C@]1(Cc2ccccc2)O)(C)CC(=O)Cc3ccccc3.CC[O-:10].[Na+]>>[H:20][O:10]CC.C[C@]1(C[C:22](=[CH:21][C@@](O1)(Cc2ccccc2)O)[O-:23])CC(=O)Cc3ccccc3.[Na+] 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][CH:21]1C(=O)C[C@@](O[C@]1(Cc2ccccc2)O)(C)CC(=O)Cc3ccccc3.CC[O-:10].[Na+]>>[H:20][O:10]CC.C[C@]1(CC(=O)[CH-:21][C@@](O1)(Cc2ccccc2)O)CC(=O)Cc3ccccc3.[Na+]
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH:21]1C(=O)C[C@@](O[C@]1(Cc2ccccc2)O)(C)CC(=O)Cc3ccccc3.CC[O-:10].[Na+]>>[H:20][O:10]CC.C[C@]1(CC(=O)[CH-:21][C@@](O1)(Cc2ccccc2)O)CC(=O)Cc3ccccc3.[Na+] 10=20;20,21=21

Reagent: 28
Reactant Smiles: C[C+]=O.COC1=CC=CO1
Highest priority first:

Priority: 2975

C[C+:20]=O.COC1=C[CH:11]=[CH:10]O1>>C[C:20](=O)[CH:10]1[CH+:11]C=C(O1)OC
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C+:20]=O.COC1=C[CH:11]=[CH:10]O1>>C[C:20](=O)[CH:10]1[CH+:11]C=C(O1)OC 10,11=10,20

Priority: 2950

C[C+:20]=O.CO[C:11]1=[CH:10]C=CO1>>C[C:20](=O)[CH:10]1C=CO[C+:11]1OC
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C+:20]=O.CO[C:11]1=[CH:10]C=CO1>>C[C:20](=O)[CH:10]1C=CO[C+:11]1OC 10,11=10,20

Priority: 2920

C[C+:20]=O.COC1=C[CH:10]=[CH:11]O1>>C[C:20](=O)[CH:10]1C=C(O[CH+:11]1)OC
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C+:20]=O.COC1=C[CH:10]=[CH:11]O1>>C[C:20](=O)[CH:10]1C=C(O[CH+:11]1)OC 10,11=10,20

Priority: 2000

C[C+:20]=O.COC1=[CH:11][CH:10]=CO1>>C[C:20](=O)[CH:10]=COC(=[CH+:11])OC
( 2 sigma 1 2 5 p None 0 )
σ_C-C > p_C C[C+:20]=O.COC1=[CH:11][CH:10]=CO1>>C[C:20](=O)[CH:10]=COC(=[CH+:11])OC 10,11=10,20

Reagent: 3
Reactant Smiles: C[C@@H]1C[C+]2C=CC=C[C@H]2[C@H]3[C@@H]1C=CC=C3CC=C
Highest priority first:

Priority: 7084

C[C@@H]1C[C+:20]2C=CC=C[C@H]2[C@H]3[C@@H]1[CH:11]=[CH:10]C=C3CC=C>>C[C@@H]1C[C:20]23C=CC=C[C@H]2[C@H]4[C@@H]1[CH+:11][CH:10]3C=C4CC=C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C C[C@@H]1C[C+:20]2C=CC=C[C@H]2[C@H]3[C@@H]1[CH:11]=[CH:10]C=C3CC=C>>C[C@@H]1C[C:20]23C=CC=C[C@H]2[C@H]4[C@@H]1[CH+:11][CH:10]3C=C4CC=C 10,11=10,20

Priority: 7082

C[C@@H]1C[C+:20]2C=CC=C[C@H]2[C@H]3[C@@H]1C=C[CH:10]=[C:11]3CC=C>>C[C@@H]1C[C:20]23C=CC=C[C@H]2[C@H]4[C@@H]1C=C[CH:10]3[C+:11]4CC=C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C C[C@@H]1C[C+:20]2C=CC=C[C@H]2[C@H]3[C@@H]1C=C[CH:10]=[C:11]3CC=C>>C[C@@H]1C[C:20]23C=CC=C[C@H]2[C@H]4[C@@H]1C=C[CH:10]3[C+:11]4CC=C 10,11=10,20

Priority: 7030

C[C@@H]1C[C+:20]2[CH:10]=[CH:11]C=C[C@H]2[C@H]3[C@@H]1C=CC=C3CC=C>>C[C@@H]1C[C:20]2=[CH:10][CH+:11]C=C[C@H]2[C@H]3[C@@H]1C=CC=C3CC=C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C C[C@@H]1C[C+:20]2[CH:10]=[CH:11]C=C[C@H]2[C@H]3[C@@H]1C=CC=C3CC=C>>C[C@@H]1C[C:20]2=[CH:10][CH+:11]C=C[C@H]2[C@H]3[C@@H]1C=CC=C3CC=C 10,11=10,20

Reagent: 3
Reactant Smiles: CC(C)[C@H]1[C@@H]2C=CC(=C[C@H]2[C@H]3[C+]1C=CC=C3)C=C(C)C
Highest priority first:

Priority: 7084

CC(C)[C@H]1[C@@H]2C=C[C:10](=[CH:11][C@H]2[C@H]3[C+:20]1C=CC=C3)C=C(C)C>>CC(C)[C@H]1[C@@H]2C=C[C:10]3([C:20]14C=CC=C[C@H]4[C@@H]2[CH+:11]3)C=C(C)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[C@@H]2C=C[C:10](=[CH:11][C@H]2[C@H]3[C+:20]1C=CC=C3)C=C(C)C>>CC(C)[C@H]1[C@@H]2C=C[C:10]3([C:20]14C=CC=C[C@H]4[C@@H]2[CH+:11]3)C=C(C)C 10,11=10,20

Priority: 7030

CC(C)[C@H]1[C@@H]2C=CC(=C[C@H]2[C@H]3[C+:20]1[CH:10]=[CH:11]C=C3)C=C(C)C>>CC(C)[C@H]1[C@@H]2C=CC(=C[C@H]2[C@H]3[C:20]1=[CH:10][CH+:11]C=C3)C=C(C)C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[C@@H]2C=CC(=C[C@H]2[C@H]3[C+:20]1[CH:10]=[CH:11]C=C3)C=C(C)C>>CC(C)[C@H]1[C@@H]2C=CC(=C[C@H]2[C@H]3[C:20]1=[CH:10][CH+:11]C=C3)C=C(C)C 10,11=10,20

Reagent: 8
Reactant Smiles: CC(=O)O/C(=C/CC=O)/O[C@@](CCC=O)([O-])OC(=O)C
Highest priority first:

Priority: 6983

CC(=O)O/C(=C/CC=O)/O[C@@:20](CCC=O)([O-:10])[O:21]C(=O)C>>CC(=O)[O-:21].CC(=O)O/C(=C/CC=O)/O[C@@:20](=[O:10])CCC=O
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CC(=O)O/C(=C/CC=O)/O[C@@:20](CCC=O)([O-:10])[O:21]C(=O)C>>CC(=O)[O-:21].CC(=O)O/C(=C/CC=O)/O[C@@:20](=[O:10])CCC=O 10=20;20,21=21

Priority: 6975

CC(=O)O/C(=C/CC=O)/[O:21][C@@:20](CCC=O)([O-:10])OC(=O)C>>CC(=O)O[C@:20](=[O:10])CCC=O.CC(=O)O/C(=C/CC=O)/[O-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CC(=O)O/C(=C/CC=O)/[O:21][C@@:20](CCC=O)([O-:10])OC(=O)C>>CC(=O)O[C@:20](=[O:10])CCC=O.CC(=O)O/C(=C/CC=O)/[O-:21] 10=20;20,21=21

Priority: 4448 $C[C:20](=[O:21])O/C(=C/CC=O)/O[C@@](CCC=O)([O-:10])OC(=O)C>>CC(=O)O[C@]1(O/C(=C\CC=O)/O[C:20]([O:10]1)(C)[O-:21])CCC=O$
C[C:20](=[O:21])O/C(=C/CC=O)/O[C@@](CCC=O)([O-:10])OC(=O)C>>CC(=O)O[C@]1(O/C(=C\CC=O)/O[C:20]([O:10]1)(C)[O-:21])CCC=O
( 5 sp3 None 2 1 pi 2 2 )
n_O > π^*_C=O C[C:20](=[O:21])O/C(=C/CC=O)/O[C@@](CCC=O)([O-:10])OC(=O)C>>CC(=O)O[C@]1(O/C(=C\CC=O)/O[C:20]([O:10]1)(C)[O-:21])CCC=O 10=20;20,21=21

Priority: 4446

CC(=O)O/C(=C/CC=O)/O[C@@](CC[CH:20]=[O:21])([O-:10])OC(=O)C>>CC(=O)O/C(=C/CC=O)/O[C@]1(CC[CH:20]([O:10]1)[O-:21])OC(=O)C
( 5 sp3 None 2 1 pi 2 2 )
n_O > π^*_C=O CC(=O)O/C(=C/CC=O)/O[C@@](CC[CH:20]=[O:21])([O-:10])OC(=O)C>>CC(=O)O/C(=C/CC=O)/O[C@]1(CC[CH:20]([O:10]1)[O-:21])OC(=O)C 10=20;20,21=21

Reagent: 140
Reactant Smiles: [1H]CC(=O)[C@H](CC(=O)C)[C@](C)(CCC(=O)C)O.CC[O-]
Highest priority first:

Priority: 4386

[H:20][CH2:21][C:22](=[O:23])[C@H](CC(=O)C)[C@](C)(CCC(=O)C)O.CC[O-:10]>>[H:20][O:10]CC.CC(=O)CC[C@@](C)([C@@H](CC(=O)C)[C:22](=[CH2:21])[O-:23])O
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH2:21][C:22](=[O:23])[C@H](CC(=O)C)[C@](C)(CCC(=O)C)O.CC[O-:10]>>[H:20][O:10]CC.CC(=O)CC[C@@](C)([C@@H](CC(=O)C)[C:22](=[CH2:21])[O-:23])O 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][CH2:21]C(=O)[C@H](CC(=O)C)[C@](C)(CCC(=O)C)O.CC[O-:10]>>[H:20][O:10]CC.CC(=O)CC[C@@](C)([C@@H](CC(=O)C)C(=O)[CH2-:21])O
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH2:21]C(=O)[C@H](CC(=O)C)[C@](C)(CCC(=O)C)O.CC[O-:10]>>[H:20][O:10]CC.CC(=O)CC[C@@](C)([C@@H](CC(=O)C)C(=O)[CH2-:21])O 10=20;20,21=21

Reagent: 8
Reactant Smiles: c1ccc(cc1)CC(=O)C[C@]2(O/C(=C\c3ccccc3)/C[C@](O2)([O-])Cl)Cl
Highest priority first:

Priority: 6990 $c1ccc(cc1)CC(=O)C[C@]2(O/C(=C\c3ccccc3)/C[C@:20](O2)([O-:10])[Cl:21])Cl>>c1ccc(cc1)CC(=O)C[C@]2(O/C(=C\c3ccccc3)/C[C@:20](=[O:10])O2)Cl.[Cl-:21]$
c1ccc(cc1)CC(=O)C[C@]2(O/C(=C\c3ccccc3)/C[C@:20](O2)([O-:10])[Cl:21])Cl>>c1ccc(cc1)CC(=O)C[C@]2(O/C(=C\c3ccccc3)/C[C@:20](=[O:10])O2)Cl.[Cl-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-Cl c1ccc(cc1)CC(=O)C[C@]2(O/C(=C\c3ccccc3)/C[C@:20](O2)([O-:10])[Cl:21])Cl>>c1ccc(cc1)CC(=O)C[C@]2(O/C(=C\c3ccccc3)/C[C@:20](=[O:10])O2)Cl.[Cl-:21] 10=20;20,21=21

Priority: 6974 $c1ccc(cc1)CC(=O)C[C@]2(O/C(=C\c3ccccc3)/C[C@:20]([O:21]2)([O-:10])Cl)Cl>>c1ccc(cc1)CC(=O)C[C@]([O-:21])(O/C(=C\c2ccccc2)/C[C@:20](=[O:10])Cl)Cl$
c1ccc(cc1)CC(=O)C[C@]2(O/C(=C\c3ccccc3)/C[C@:20]([O:21]2)([O-:10])Cl)Cl>>c1ccc(cc1)CC(=O)C[C@]([O-:21])(O/C(=C\c2ccccc2)/C[C@:20](=[O:10])Cl)Cl
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O c1ccc(cc1)CC(=O)C[C@]2(O/C(=C\c3ccccc3)/C[C@:20]([O:21]2)([O-:10])Cl)Cl>>c1ccc(cc1)CC(=O)C[C@]([O-:21])(O/C(=C\c2ccccc2)/C[C@:20](=[O:10])Cl)Cl 10=20;20,21=21

Priority: 5101 $c1ccc(cc1)CC(=O)C[C@:20]2(O/C(=C\c3ccccc3)/C[C@](O2)([O-:10])Cl)[Cl:21]>>c1ccc(cc1)CC(=O)C[C@:20]23O/C(=C\c4ccccc4)/C[C@](O2)([O:10]3)Cl.[Cl-:21]$
c1ccc(cc1)CC(=O)C[C@:20]2(O/C(=C\c3ccccc3)/C[C@](O2)([O-:10])Cl)[Cl:21]>>c1ccc(cc1)CC(=O)C[C@:20]23O/C(=C\c4ccccc4)/C[C@](O2)([O:10]3)Cl.[Cl-:21]
( 1 sp3 None 2 4 sigma 5 2 )
n_O > σ^*_C-Cl c1ccc(cc1)CC(=O)C[C@:20]2(O/C(=C\c3ccccc3)/C[C@](O2)([O-:10])Cl)[Cl:21]>>c1ccc(cc1)CC(=O)C[C@:20]23O/C(=C\c4ccccc4)/C[C@](O2)([O:10]3)Cl.[Cl-:21] 10=20;20,21=21

Priority: 4446 $c1ccc(cc1)C[C:20](=[O:21])C[C@]2(O/C(=C\c3ccccc3)/C[C@](O2)([O-:10])Cl)Cl>>c1ccc(cc1)C[C:20]2(C[C@]3(O/C(=C\c4ccccc4)/C[C@@]([O:10]2)(O3)Cl)Cl)[O-:21]$
c1ccc(cc1)C[C:20](=[O:21])C[C@]2(O/C(=C\c3ccccc3)/C[C@](O2)([O-:10])Cl)Cl>>c1ccc(cc1)C[C:20]2(C[C@]3(O/C(=C\c4ccccc4)/C[C@@]([O:10]2)(O3)Cl)Cl)[O-:21]
( 5 sp3 None 2 1 pi 2 2 )
n_O > π^*_C=O c1ccc(cc1)C[C:20](=[O:21])C[C@]2(O/C(=C\c3ccccc3)/C[C@](O2)([O-:10])Cl)Cl>>c1ccc(cc1)C[C:20]2(C[C@]3(O/C(=C\c4ccccc4)/C[C@@]([O:10]2)(O3)Cl)Cl)[O-:21] 10=20;20,21=21

Reagent: 3
Reactant Smiles: CC[C@@H](c1ccccc1)C2C=CC(C=C2)(/C=C/C)[C@H]3C=CC(=C[CH+]3)/C=C/C
Highest priority first:

Priority: 7082

CC[C@@H](c1ccccc1)C2C=CC(C=C2)(/[CH:11]=[CH:10]/C)[C@H]3C=CC(=C[CH+:20]3)/C=C/C>>CC[C@@H](c1ccccc1)C2C=CC3(C=C2)[CH+:11][CH:10]([CH:20]4[C@@H]3C=CC(=C4)/C=C/C)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC[C@@H](c1ccccc1)C2C=CC(C=C2)(/[CH:11]=[CH:10]/C)[C@H]3C=CC(=C[CH+:20]3)/C=C/C>>CC[C@@H](c1ccccc1)C2C=CC3(C=C2)[CH+:11][CH:10]([CH:20]4[C@@H]3C=CC(=C4)/C=C/C)C 10,11=10,20

Priority: 7030

CC[C@@H](c1ccccc1)C2C=CC(C=C2)(/C=C/C)[C@H]3C=C[C:11](=[CH:10][CH+:20]3)/C=C/C>>CC[C@@H](c1ccccc1)C2C=CC(C=C2)(/C=C/C)[C@H]3C=C[C+:11]([CH:10]=[CH:20]3)/C=C/C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CC[C@@H](c1ccccc1)C2C=CC(C=C2)(/C=C/C)[C@H]3C=C[C:11](=[CH:10][CH+:20]3)/C=C/C>>CC[C@@H](c1ccccc1)C2C=CC(C=C2)(/C=C/C)[C@H]3C=C[C+:11]([CH:10]=[CH:20]3)/C=C/C 10,11=10,20

Reagent: 28
Reactant Smiles: CC(=O)[C@@H]1C=c2c(=C[CH+]1)cccc2S(=O)(=O)O.c1ccc2=C(C=CC=c2c1)S(=O)(=O)O
Highest priority first:

Priority: 2741

CC(=O)[C@@H]1C=c2c(=C[CH+:20]1)cccc2S(=O)(=O)O.c1ccc2=C([CH:11]=[CH:10]C=c2c1)S(=O)(=O)O>>CC(=O)[C@@H]1C=c2c(=C[CH:20]1[CH:10]3C=c4ccccc4=C([CH+:11]3)S(=O)(=O)O)cccc2S(=O)(=O)O
( 3 pi 2 2 5 p None 0 )
π_C=C > p_C CC(=O)[C@@H]1C=c2c(=C[CH+:20]1)cccc2S(=O)(=O)O.c1ccc2=C([CH:11]=[CH:10]C=c2c1)S(=O)(=O)O>>CC(=O)[C@@H]1C=c2c(=C[CH:20]1[CH:10]3C=c4ccccc4=C([CH+:11]3)S(=O)(=O)O)cccc2S(=O)(=O)O 10,11=10,20

Priority: 2000

CC(=O)[C@@H]1C=c2c(=C[CH+:20]1)cccc2S(=O)(=O)O.c1ccc2=C([CH:11]=[CH:10]C=c2c1)S(=O)(=O)O>>CC(=O)[C@@H]1C=c2c(=C[CH:20]1[CH:10]3C=c4ccccc4=C([CH+:11]3)S(=O)(=O)O)cccc2S(=O)(=O)O
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(=O)[C@@H]1C=c2c(=C[CH+:20]1)cccc2S(=O)(=O)O.c1ccc2=C([CH:11]=[CH:10]C=c2c1)S(=O)(=O)O>>CC(=O)[C@@H]1C=c2c(=C[CH:20]1[CH:10]3C=c4ccccc4=C([CH+:11]3)S(=O)(=O)O)cccc2S(=O)(=O)O 10,11=10,20

Reagent: 26
Reactant Smiles: c1cc2=C[CH+][C@@H](C=c2c(c1)C#N)S(=O)(=O)O.C1=CC2=C[CH+][C@@H](C=C2C(=C1)C#N)S(=O)(=O)O
Highest priority first:

Priority: 2730

c1cc2=C[CH+:20][C@@H](C=c2c(c1)C#N)S(=O)(=O)O.[CH:10]1=CC2=C[CH+][C@@H](C=C2C(=[CH:11]1)C#N)S(=O)(=O)O>>[CH+:11]=C(C#N)C1=C[C@H]([CH+]C=C1C=[CH:10][CH:20]2C=c3cccc(c3=C[C@H]2S(=O)(=O)O)C#N)S(=O)(=O)O
( 3 sigma 2 2 5 p None 0 )
σ_C-C > p_C c1cc2=C[CH+:20][C@@H](C=c2c(c1)C#N)S(=O)(=O)O.[CH:10]1=CC2=C[CH+][C@@H](C=C2C(=[CH:11]1)C#N)S(=O)(=O)O>>[CH+:11]=C(C#N)C1=C[C@H]([CH+]C=C1C=[CH:10][CH:20]2C=c3cccc(c3=C[C@H]2S(=O)(=O)O)C#N)S(=O)(=O)O 10,11=10,20

Priority: 2500

c1cc2=C[CH+:20][C@@H](C=c2c(c1)C#N)S(=O)(=O)O.C1=CC2=C[CH+][C@@H](C=C2[C:11](=[CH:10]1)C#N)S(=O)(=O)O>>c1cc2=C[CH:20]([C@@H](C=c2c(c1)C#N)S(=O)(=O)O)[CH:10]3C=CC4=C[CH+][C@@H](C=C4[C+:11]3C#N)S(=O)(=O)O
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C c1cc2=C[CH+:20][C@@H](C=c2c(c1)C#N)S(=O)(=O)O.C1=CC2=C[CH+][C@@H](C=C2[C:11](=[CH:10]1)C#N)S(=O)(=O)O>>c1cc2=C[CH:20]([C@@H](C=c2c(c1)C#N)S(=O)(=O)O)[CH:10]3C=CC4=C[CH+][C@@H](C=C4[C+:11]3C#N)S(=O)(=O)O 10,11=10,20

Priority: 2000

c1cc2=C[CH+:20][C@@H](C=c2c(c1)C#N)S(=O)(=O)O.[CH:10]1=CC2=C[CH+][C@@H](C=C2C(=[CH:11]1)C#N)S(=O)(=O)O>>[CH+:11]=C(C#N)C1=C[C@H]([CH+]C=C1C=[CH:10][CH:20]2C=c3cccc(c3=C[C@H]2S(=O)(=O)O)C#N)S(=O)(=O)O
( 2 sigma 1 2 5 p None 0 )
σ_C-C > p_C c1cc2=C[CH+:20][C@@H](C=c2c(c1)C#N)S(=O)(=O)O.[CH:10]1=CC2=C[CH+][C@@H](C=C2C(=[CH:11]1)C#N)S(=O)(=O)O>>[CH+:11]=C(C#N)C1=C[C@H]([CH+]C=C1C=[CH:10][CH:20]2C=c3cccc(c3=C[C@H]2S(=O)(=O)O)C#N)S(=O)(=O)O 10,11=10,20

Reagent: 140
Reactant Smiles: CC[O@@H+][C@](CC(=O)[C@H](c1ccccc1)[C@@](c2ccccc2)([O-])OC(=O)CC(=O)Cc3ccccc3)(O)OC(=O)c4ccccc4
Highest priority first:

Priority: 6983

CC[O@@H+][C@](CC(=O)[C@H](c1ccccc1)[C@@:20](c2ccccc2)([O-:10])[O:21]C(=O)CC(=O)Cc3ccccc3)(O)OC(=O)c4ccccc4>>CC[O@@H+][C@](CC(=O)[C@H](c1ccccc1)[C@@:20](=[O:10])c2ccccc2)(O)OC(=O)c3ccccc3.c1ccc(cc1)CC(=O)CC(=O)[O-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CC[O@@H+][C@](CC(=O)[C@H](c1ccccc1)[C@@:20](c2ccccc2)([O-:10])[O:21]C(=O)CC(=O)Cc3ccccc3)(O)OC(=O)c4ccccc4>>CC[O@@H+][C@](CC(=O)[C@H](c1ccccc1)[C@@:20](=[O:10])c2ccccc2)(O)OC(=O)c3ccccc3.c1ccc(cc1)CC(=O)CC(=O)[O-:21] 10=20;20,21=21

Priority: 4446

CC[O@@H+][C@](CC(=O)[C@H](c1ccccc1)[C@@](c2ccccc2)([O-:10])OC(=O)C[C:20](=[O:21])Cc3ccccc3)(O)OC(=O)c4ccccc4>>CC[O@@H+][C@](CC(=O)[C@H](c1ccccc1)[C@@]2(OC(=O)C[C:20]([O:10]2)(Cc3ccccc3)[O-:21])c4ccccc4)(O)OC(=O)c5ccccc5
( 5 sp3 None 2 1 pi 2 2 )
n_O > π^*_C=O CC[O@@H+][C@](CC(=O)[C@H](c1ccccc1)[C@@](c2ccccc2)([O-:10])OC(=O)C[C:20](=[O:21])Cc3ccccc3)(O)OC(=O)c4ccccc4>>CC[O@@H+][C@](CC(=O)[C@H](c1ccccc1)[C@@]2(OC(=O)C[C:20]([O:10]2)(Cc3ccccc3)[O-:21])c4ccccc4)(O)OC(=O)c5ccccc5 10=20;20,21=21

Reagent: 8
Reactant Smiles: COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Priority: 2955

COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@H]3C=CC=C4[C+]3C=CC=C4C#N)C#N.c1ccc2c(c1)C=CC=C2C#N
Highest priority first:

Priority: 2550

CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@H]3C=CC=C4[C+:20]3C=CC=C4C#N)C#N.c1ccc2c(c1)[CH:10]=[CH:11][CH:12]=[C:13]2C#N>>CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@H]3C=CC=C4[C:20]3(C=CC=C4C#N)[CH:10]5[CH:11]=[CH:12][C+:13](c6c5cccc6)C#N)C#N
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@H]3C=CC=C4[C+:20]3C=CC=C4C#N)C#N.c1ccc2c(c1)[CH:10]=[CH:11][CH:12]=[C:13]2C#N>>CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@H]3C=CC=C4[C:20]3(C=CC=C4C#N)[CH:10]5[CH:11]=[CH:12][C+:13](c6c5cccc6)C#N)C#N 10,11=10,20;12,13=11,12

Priority: 2500

CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@H]3C=CC=C4[C+:20]3C=CC=C4C#N)C#N.c1ccc2c(c1)C=C[CH:10]=[C:11]2C#N>>CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@H]3C=CC=C4[C:20]3(C=CC=C4C#N)[CH:10]5C=Cc6ccccc6[C+:11]5C#N)C#N
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@H]3C=CC=C4[C+:20]3C=CC=C4C#N)C#N.c1ccc2c(c1)C=C[CH:10]=[C:11]2C#N>>CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@H]3C=CC=C4[C:20]3(C=CC=C4C#N)[CH:10]5C=Cc6ccccc6[C+:11]5C#N)C#N 10,11=10,20

Priority: 2000

CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@H]3C=CC=C4[C+:20]3C=CC=C4C#N)C#N.c1ccc2c(c1)[CH:11]=[CH:10]C=C2C#N>>CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@H]3C=CC=C4[C:20]3(C=CC=C4C#N)[CH:10]5C=C(c6ccccc6[CH+:11]5)C#N)C#N
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@H]3C=CC=C4[C+:20]3C=CC=C4C#N)C#N.c1ccc2c(c1)[CH:11]=[CH:10]C=C2C#N>>CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@H]3C=CC=C4[C:20]3(C=CC=C4C#N)[CH:10]5C=C(c6ccccc6[CH+:11]5)C#N)C#N 10,11=10,20

Reagent: 3
Reactant Smiles: C=C(c1ccccc1)[C@@H]2C=C(C=C[C@H]2[C@@H]3C=C(C=C[CH+]3)C#C)C#C.C=C([C@@H]1C=C(C=C[C@H]1[C@@H]2C=C(C=C[CH+]2)C#C)C#C)C3=CC=CC=C3
Highest priority first:

Priority: 2500

C=C(c1ccccc1)[C@@H]2C=C(C=C[C@H]2[C@@H]3C=C(C=C[CH+:20]3)C#C)C#C.C=C([C@@H]1C=C(C=C[C@H]1[C@@H]2C=C(C=C[CH+]2)C#C)C#C)[C:11]3=[CH:10]C=CC=C3>>C=C(c1ccccc1)[C@@H]2C=C(C=C[C@H]2[C@@H]3C=C(C=C[CH:20]3[CH:10]4C=CC=C[C+:11]4C(=C)[C@@H]5C=C(C=C[C@H]5[C@@H]6C=C(C=C[CH+]6)C#C)C#C)C#C)C#C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C=C(c1ccccc1)[C@@H]2C=C(C=C[C@H]2[C@@H]3C=C(C=C[CH+:20]3)C#C)C#C.C=C([C@@H]1C=C(C=C[C@H]1[C@@H]2C=C(C=C[CH+]2)C#C)C#C)[C:11]3=[CH:10]C=CC=C3>>C=C(c1ccccc1)[C@@H]2C=C(C=C[C@H]2[C@@H]3C=C(C=C[CH:20]3[CH:10]4C=CC=C[C+:11]4C(=C)[C@@H]5C=C(C=C[C@H]5[C@@H]6C=C(C=C[CH+]6)C#C)C#C)C#C)C#C 10,11=10,20

Priority: 2000

C=C(c1ccccc1)[C@@H]2C=C(C=C[C@H]2[C@@H]3C=C(C=C[CH+:20]3)C#C)C#C.C=C([C@@H]1C=C(C=C[C@H]1[C@@H]2C=C(C=C[CH+]2)C#C)C#C)C3=C[CH:10]=[CH:11]C=C3>>C=C(c1ccccc1)[C@@H]2C=C(C=C[C@H]2[C@@H]3C=C(C=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)C(=C)[C@@H]5C=C(C=C[C@H]5[C@@H]6C=C(C=C[CH+]6)C#C)C#C)C#C)C#C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C=C(c1ccccc1)[C@@H]2C=C(C=C[C@H]2[C@@H]3C=C(C=C[CH+:20]3)C#C)C#C.C=C([C@@H]1C=C(C=C[C@H]1[C@@H]2C=C(C=C[CH+]2)C#C)C#C)C3=C[CH:10]=[CH:11]C=C3>>C=C(c1ccccc1)[C@@H]2C=C(C=C[C@H]2[C@@H]3C=C(C=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)C(=C)[C@@H]5C=C(C=C[C@H]5[C@@H]6C=C(C=C[CH+]6)C#C)C#C)C#C)C#C 10,11=10,20

Reagent: 87
Reactant Smiles: c1ccc(cc1)CC(=O)C[C@@]([OH2+])(OC(=O)c2ccccc2)O[C@](CC(=O)Cc3ccccc3)(O)O[C@](c4ccccc4)(O)[O-]
Highest priority first:

Priority: 6975

c1ccc(cc1)CC(=O)C[C@@]([OH2+])(OC(=O)c2ccccc2)O[C@](CC(=O)Cc3ccccc3)(O)O[C@:20](c4ccccc4)([OH:21])[O-:10]>>c1ccc(cc1)CC(=O)C[C@@]([OH2+])(OC(=O)c2ccccc2)O[C@](CC(=O)Cc3ccccc3)(O)O[C@:20](=[O:10])c4ccccc4.[OH-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O c1ccc(cc1)CC(=O)C[C@@]([OH2+])(OC(=O)c2ccccc2)O[C@](CC(=O)Cc3ccccc3)(O)O[C@:20](c4ccccc4)([OH:21])[O-:10]>>c1ccc(cc1)CC(=O)C[C@@]([OH2+])(OC(=O)c2ccccc2)O[C@](CC(=O)Cc3ccccc3)(O)O[C@:20](=[O:10])c4ccccc4.[OH-:21] 10=20;20,21=21

Priority: 4446

c1ccc(cc1)CC(=O)C[C@@]([OH2+])(OC(=O)c2ccccc2)O[C@](C[C:20](=[O:21])Cc3ccccc3)(O)O[C@](c4ccccc4)(O)[O-:10]>>c1ccc(cc1)CC(=O)C[C@@]([OH2+])(OC(=O)c2ccccc2)O[C@]3(C[C:20]([O:10][C@@](O3)(c4ccccc4)O)(Cc5ccccc5)[O-:21])O
( 5 sp3 None 2 1 pi 2 2 )
n_O > π^*_C=O c1ccc(cc1)CC(=O)C[C@@]([OH2+])(OC(=O)c2ccccc2)O[C@](C[C:20](=[O:21])Cc3ccccc3)(O)O[C@](c4ccccc4)(O)[O-:10]>>c1ccc(cc1)CC(=O)C[C@@]([OH2+])(OC(=O)c2ccccc2)O[C@]3(C[C:20]([O:10][C@@](O3)(c4ccccc4)O)(Cc5ccccc5)[O-:21])O 10=20;20,21=21

Reagent: 3
Reactant Smiles: C=C(c1ccccc1)C2C=CC(C=C2)(C#C)[C@H]3C=CC=C[C+]3C#C.C=C(C1C=CC(C=C1)(C#C)[C@H]2C=CC=C[C+]2C#C)C3=CC=CC=C3
Highest priority first:

Priority: 2500

C=C(c1ccccc1)C2C=CC(C=C2)(C#C)[C@H]3C=CC=C[C+:20]3C#C.C=C(C1C=CC(C=C1)(C#C)[C@H]2C=CC=C[C+]2C#C)[C:11]3=[CH:10]C=CC=C3>>C=C(c1ccccc1)C2C=CC(C=C2)(C#C)[C@H]3C=CC=C[C:20]3(C#C)[CH:10]4C=CC=C[C+:11]4C(=C)C5C=CC(C=C5)(C#C)[C@H]6C=CC=C[C+]6C#C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C=C(c1ccccc1)C2C=CC(C=C2)(C#C)[C@H]3C=CC=C[C+:20]3C#C.C=C(C1C=CC(C=C1)(C#C)[C@H]2C=CC=C[C+]2C#C)[C:11]3=[CH:10]C=CC=C3>>C=C(c1ccccc1)C2C=CC(C=C2)(C#C)[C@H]3C=CC=C[C:20]3(C#C)[CH:10]4C=CC=C[C+:11]4C(=C)C5C=CC(C=C5)(C#C)[C@H]6C=CC=C[C+]6C#C 10,11=10,20

Priority: 2000

C=C(c1ccccc1)C2C=CC(C=C2)(C#C)[C@H]3C=CC=C[C+:20]3C#C.C=C(C1C=CC(C=C1)(C#C)[C@H]2C=CC=C[C+]2C#C)C3=C[CH:10]=[CH:11]C=C3>>C=C(c1ccccc1)C2C=CC(C=C2)(C#C)[C@H]3C=CC=C[C:20]3(C#C)[CH:10]4C=C(C=C[CH+:11]4)C(=C)C5C=CC(C=C5)(C#C)[C@H]6C=CC=C[C+]6C#C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C=C(c1ccccc1)C2C=CC(C=C2)(C#C)[C@H]3C=CC=C[C+:20]3C#C.C=C(C1C=CC(C=C1)(C#C)[C@H]2C=CC=C[C+]2C#C)C3=C[CH:10]=[CH:11]C=C3>>C=C(c1ccccc1)C2C=CC(C=C2)(C#C)[C@H]3C=CC=C[C:20]3(C#C)[CH:10]4C=C(C=C[CH+:11]4)C(=C)C5C=CC(C=C5)(C#C)[C@H]6C=CC=C[C+]6C#C 10,11=10,20

Reagent: 87
Reactant Smiles: [1H]C(C(=O)Cc1ccccc1)[N+](=O)[O-].[OH-]
Highest priority first:

Priority: 4424

[H:20][CH:21]([C:22](=[O:23])Cc1ccccc1)[N+](=O)[O-].[OH-:10]>>[H:20][OH:10].c1ccc(cc1)C[C:22](=[CH:21][N+](=O)[O-])[O-:23]
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH:21]([C:22](=[O:23])Cc1ccccc1)[N+](=O)[O-].[OH-:10]>>[H:20][OH:10].c1ccc(cc1)C[C:22](=[CH:21][N+](=O)[O-])[O-:23] 10=20;20,21=21,22;22,23=23

Priority: 4420

[H:20][CH:21](C(=O)Cc1ccccc1)[N+](=O)[O-].[OH-:10]>>[H:20][OH:10].c1ccc(cc1)CC(=O)[CH-:21][N+](=O)[O-]
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH:21](C(=O)Cc1ccccc1)[N+](=O)[O-].[OH-:10]>>[H:20][OH:10].c1ccc(cc1)CC(=O)[CH-:21][N+](=O)[O-] 10=20;20,21=21

Reagent: 3
Reactant Smiles: C[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@H]3C=C(C=C[CH+]3)C=C)C=C
Highest priority first:

Priority: 7084

C[C@@H](c1ccccc1)[C@@H]2[CH:11]=[CH:10]C=C([C@H]2[C@H]3C=C(C=C[CH+:20]3)C=C)C=C>>C[C@@H](c1ccccc1)[C@@H]2[CH+:11][CH:10]3C=C([C@H]2[C@@H]4[CH:20]3C=CC(=C4)C=C)C=C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C C[C@@H](c1ccccc1)[C@@H]2[CH:11]=[CH:10]C=C([C@H]2[C@H]3C=C(C=C[CH+:20]3)C=C)C=C>>C[C@@H](c1ccccc1)[C@@H]2[CH+:11][CH:10]3C=C([C@H]2[C@@H]4[CH:20]3C=CC(=C4)C=C)C=C 10,11=10,20

Priority: 7082

C[C@@H](c1ccccc1)[C@@H]2C=C[CH:10]=[C:11]([C@H]2[C@H]3C=C(C=C[CH+:20]3)C=C)C=C>>C[C@@H](c1ccccc1)[C@@H]2C=C[CH:10]3[CH:20]4C=CC(=C[C@@H]4[C@@H]2[C+:11]3C=C)C=C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C C[C@@H](c1ccccc1)[C@@H]2C=C[CH:10]=[C:11]([C@H]2[C@H]3C=C(C=C[CH+:20]3)C=C)C=C>>C[C@@H](c1ccccc1)[C@@H]2C=C[CH:10]3[CH:20]4C=CC(=C[C@@H]4[C@@H]2[C+:11]3C=C)C=C 10,11=10,20

Priority: 7030

C[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@H]3C=C([CH:11]=[CH:10][CH+:20]3)C=C)C=C>>C[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@@H]3[CH:20]=[CH:10][CH+:11]C(=C3)C=C)C=C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C C[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@H]3C=C([CH:11]=[CH:10][CH+:20]3)C=C)C=C>>C[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@@H]3[CH:20]=[CH:10][CH+:11]C(=C3)C=C)C=C 10,11=10,20

Reagent: 87
Reactant Smiles: CC(=O)CC(=O)[C@H](c1ccccc1)[C@@](Cc2ccccc2)(CC(=C)[O-])O
Highest priority first:

Priority: 4477

CC(=O)C[C:20](=[O:21])[C@H](c1ccccc1)[C@@](Cc2ccccc2)(C[C:11](=[CH2:10])[O-:12])O>>CC(=O)C[C:20]1([CH2:10][C:11](=[O:12])C[C@@]([C@H]1c2ccccc2)(Cc3ccccc3)O)[O-:21]
( 7 pi 8 2; 9 sp3 None 2 1 pi 2 2 )
n_O > π_C=C > π^*_C=O CC(=O)C[C:20](=[O:21])[C@H](c1ccccc1)[C@@](Cc2ccccc2)(C[C:11](=[CH2:10])[O-:12])O>>CC(=O)C[C:20]1([CH2:10][C:11](=[O:12])C[C@@]([C@H]1c2ccccc2)(Cc3ccccc3)O)[O-:21] 10,11=10,20;12=11;20,21=21

Priority: 4446

CC(=O)C[C:20](=[O:21])[C@H](c1ccccc1)[C@@](Cc2ccccc2)(CC(=C)[O-:10])O>>CC(=O)C[C:20]1([C@@H]([C@](CC(=C)[O:10]1)(Cc2ccccc2)O)c3ccccc3)[O-:21]
( 5 sp3 None 2 1 pi 2 2 )
n_O > π^*_C=O CC(=O)C[C:20](=[O:21])[C@H](c1ccccc1)[C@@](Cc2ccccc2)(CC(=C)[O-:10])O>>CC(=O)C[C:20]1([C@@H]([C@](CC(=C)[O:10]1)(Cc2ccccc2)O)c3ccccc3)[O-:21] 10=20;20,21=21

Reagent: 3
Reactant Smiles: CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=CC=C[C+]2C=C)C=C.C=CC1=CC=CC=C1
Highest priority first:

Priority: 2500

CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=CC=C[C+:20]2C=C)C=C.C=C[C:11]1=[CH:10]C=CC=C1>>CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=CC=C[C:20]2(C=C)[CH:10]3C=CC=C[C+:11]3C=C)C=C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=CC=C[C+:20]2C=C)C=C.C=C[C:11]1=[CH:10]C=CC=C1>>CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=CC=C[C:20]2(C=C)[CH:10]3C=CC=C[C+:11]3C=C)C=C 10,11=10,20

Priority: 2000

CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=CC=C[C+:20]2C=C)C=C.C=CC1=C[CH:10]=[CH:11]C=C1>>CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=CC=C[C:20]2(C=C)[CH:10]3C=C(C=C[CH+:11]3)C=C)C=C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=CC=C[C+:20]2C=C)C=C.C=CC1=C[CH:10]=[CH:11]C=C1>>CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=CC=C[C:20]2(C=C)[CH:10]3C=C(C=C[CH+:11]3)C=C)C=C 10,11=10,20

Reagent: 87
Reactant Smiles: [1H]CC(=O)C.[OH-]
Highest priority first:

Priority: 4377

[H:20][CH2:21][C:22](=[O:23])C.[OH-:10]>>[H:20][OH:10].C[C:22](=[CH2:21])[O-:23]
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH2:21][C:22](=[O:23])C.[OH-:10]>>[H:20][OH:10].C[C:22](=[CH2:21])[O-:23] 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][CH2:21]C(=O)C.[OH-:10]>>[H:20][OH:10].CC(=O)[CH2-:21]
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH2:21]C(=O)C.[OH-:10]>>[H:20][OH:10].CC(=O)[CH2-:21] 10=20;20,21=21

Reagent: 3
Reactant Smiles: CC(C)[C@H]1C=CC(=C[C@H]1[C@@H]2C=C(C=C[CH+]2)C(C)C)C(C)C
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[CH:10]C(=C[C@H]1[C@@H]2C=C(C=C[CH+:20]2)C(C)C)C(C)C>>CC(C)[C@H]1[CH+:11][CH:10]2[CH:20]3C=CC(=C[C@H]3[C@@H]1C=C2C(C)C)C(C)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[CH:10]C(=C[C@H]1[C@@H]2C=C(C=C[CH+:20]2)C(C)C)C(C)C>>CC(C)[C@H]1[CH+:11][CH:10]2[CH:20]3C=CC(=C[C@H]3[C@@H]1C=C2C(C)C)C(C)C 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=C[C:10](=[CH:11][C@H]1[C@@H]2C=C(C=C[CH+:20]2)C(C)C)C(C)C>>CC(C)[C@H]1C=C[C:10]2([CH+:11][C@H]1[C@H]3[CH:20]2C=CC(=C3)C(C)C)C(C)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=C[C:10](=[CH:11][C@H]1[C@@H]2C=C(C=C[CH+:20]2)C(C)C)C(C)C>>CC(C)[C@H]1C=C[C:10]2([CH+:11][C@H]1[C@H]3[CH:20]2C=CC(=C3)C(C)C)C(C)C 10,11=10,20

Priority: 7030

CC(C)[C@H]1C=CC(=C[C@H]1[C@@H]2C=C([CH:11]=[CH:10][CH+:20]2)C(C)C)C(C)C>>CC(C)[C@H]1C=CC(=C[C@H]1[C@H]2[CH:20]=[CH:10][CH+:11]C(=C2)C(C)C)C(C)C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC(=C[C@H]1[C@@H]2C=C([CH:11]=[CH:10][CH+:20]2)C(C)C)C(C)C>>CC(C)[C@H]1C=CC(=C[C@H]1[C@H]2[CH:20]=[CH:10][CH+:11]C(=C2)C(C)C)C(C)C 10,11=10,20

Reagent: 8
Reactant Smiles: COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Priority: 2955

COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>COC1=C[C@@H]([CH+]C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=C[C@@H]([CH+]C=C3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Reagent: 3
Reactant Smiles: CC(C)[C@@H]1[C@@H]2C=C(C=C[C@H]2[C@H]3[C+]1C=CC=C3)C=C(C)C.CC(=CC1=CC=CC=C1)C
Highest priority first:

Priority: 2500

CC(C)[C@@H]1[C@@H]2C=C(C=C[C@H]2[C@H]3[C+:20]1C=CC=C3)C=C(C)C.CC(=C[C:11]1=[CH:10]C=CC=C1)C>>CC(C)[C@@H]1[C@@H]2C=C(C=C[C@H]2[C@H]3[C:20]1(C=CC=C3)[CH:10]4C=CC=C[C+:11]4C=C(C)C)C=C(C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[C@@H]2C=C(C=C[C@H]2[C@H]3[C+:20]1C=CC=C3)C=C(C)C.CC(=C[C:11]1=[CH:10]C=CC=C1)C>>CC(C)[C@@H]1[C@@H]2C=C(C=C[C@H]2[C@H]3[C:20]1(C=CC=C3)[CH:10]4C=CC=C[C+:11]4C=C(C)C)C=C(C)C 10,11=10,20

Priority: 2000

CC(C)[C@@H]1[C@@H]2C=C(C=C[C@H]2[C@H]3[C+:20]1C=CC=C3)C=C(C)C.CC(=CC1=C[CH:10]=[CH:11]C=C1)C>>CC(C)[C@@H]1[C@@H]2C=C(C=C[C@H]2[C@H]3[C:20]1(C=CC=C3)[CH:10]4C=C(C=C[CH+:11]4)C=C(C)C)C=C(C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[C@@H]2C=C(C=C[C@H]2[C@H]3[C+:20]1C=CC=C3)C=C(C)C.CC(=CC1=C[CH:10]=[CH:11]C=C1)C>>CC(C)[C@@H]1[C@@H]2C=C(C=C[C@H]2[C@H]3[C:20]1(C=CC=C3)[CH:10]4C=C(C=C[CH+:11]4)C=C(C)C)C=C(C)C 10,11=10,20

Reagent: 3
Reactant Smiles: C[C@@H]1CC[C@@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C+]3CCC=C
Highest priority first:

Priority: 7084

C[C@@H]1CC[C@@]2([C@H]1[CH:11]=[CH:10]C=C2)[C@H]3C=CC=C[C+:20]3CCC=C>>C[C@@H]1CC[C@]23[C@H]1[CH+:11][CH:10](C=C2)[C:20]4([C@@H]3C=CC=C4)CCC=C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C C[C@@H]1CC[C@@]2([C@H]1[CH:11]=[CH:10]C=C2)[C@H]3C=CC=C[C+:20]3CCC=C>>C[C@@H]1CC[C@]23[C@H]1[CH+:11][CH:10](C=C2)[C:20]4([C@@H]3C=CC=C4)CCC=C 10,11=10,20

Priority: 7082

C[C@@H]1CC[C@@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C+:20]3CC[CH:11]=[CH2:10]>>C[C@@H]1CC[C@@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C:20]34CC[CH+:11][CH2:10]4
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C C[C@@H]1CC[C@@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C+:20]3CC[CH:11]=[CH2:10]>>C[C@@H]1CC[C@@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C:20]34CC[CH+:11][CH2:10]4 10,11=10,20

Priority: 7030

C[C@@H]1CC[C@@]2([C@H]1C=CC=C2)[C@H]3C=C[CH:11]=[CH:10][C+:20]3CCC=C>>C[C@@H]1CC[C@@]2([C@H]1C=CC=C2)[C@H]3C=C[CH+:11][CH:10]=[C:20]3CCC=C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C C[C@@H]1CC[C@@]2([C@H]1C=CC=C2)[C@H]3C=C[CH:11]=[CH:10][C+:20]3CCC=C>>C[C@@H]1CC[C@@]2([C@H]1C=CC=C2)[C@H]3C=C[CH+:11][CH:10]=[C:20]3CCC=C 10,11=10,20

Reagent: 3
Reactant Smiles: CO/C=C/C1=CC=CC=C1.CO/C=C/C1=C[C@@H]([C@@H](C=C1)[C@@H](Cc2ccccc2)OC)[C@H]3C=CC=C[C+]3/C=C/OC
Highest priority first:

Priority: 2500

CO/C=C/[C:11]1=[CH:10]C=CC=C1.CO/C=C/C1=C[C@@H]([C@@H](C=C1)[C@@H](Cc2ccccc2)OC)[C@H]3C=CC=C[C+:20]3/C=C/OC>>CO/C=C/C1=C[C@@H]([C@@H](C=C1)[C@@H](Cc2ccccc2)OC)[C@H]3C=CC=C[C:20]3(/C=C/OC)[CH:10]4C=CC=C[C+:11]4/C=C/OC
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CO/C=C/[C:11]1=[CH:10]C=CC=C1.CO/C=C/C1=C[C@@H]([C@@H](C=C1)[C@@H](Cc2ccccc2)OC)[C@H]3C=CC=C[C+:20]3/C=C/OC>>CO/C=C/C1=C[C@@H]([C@@H](C=C1)[C@@H](Cc2ccccc2)OC)[C@H]3C=CC=C[C:20]3(/C=C/OC)[CH:10]4C=CC=C[C+:11]4/C=C/OC 10,11=10,20

Priority: 2000

CO/C=C/C1=C[CH:10]=[CH:11]C=C1.CO/C=C/C1=C[C@@H]([C@@H](C=C1)[C@@H](Cc2ccccc2)OC)[C@H]3C=CC=C[C+:20]3/C=C/OC>>CO/C=C/C1=C[CH:10]([CH+:11]C=C1)[C:20]2(C=CC=C[C@@H]2[C@H]3C=C(C=C[C@H]3[C@@H](Cc4ccccc4)OC)/C=C/OC)/C=C/OC
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CO/C=C/C1=C[CH:10]=[CH:11]C=C1.CO/C=C/C1=C[C@@H]([C@@H](C=C1)[C@@H](Cc2ccccc2)OC)[C@H]3C=CC=C[C+:20]3/C=C/OC>>CO/C=C/C1=C[CH:10]([CH+:11]C=C1)[C:20]2(C=CC=C[C@@H]2[C@H]3C=C(C=C[C@H]3[C@@H](Cc4ccccc4)OC)/C=C/OC)/C=C/OC 10,11=10,20

Reagent: 3
Reactant Smiles: CC(C)[C@@H]1C=C(C=C[C@H]1[C@H]2C=CC(=C[CH+]2)C(C)C)C(C)C.CC(C)C1=CC=CC=C1
Highest priority first:

Priority: 2500

CC(C)[C@@H]1C=C(C=C[C@H]1[C@H]2C=CC(=C[CH+:20]2)C(C)C)C(C)C.CC(C)[C:13]1=[CH:12][CH:11]=[CH:10]C=C1>>CC(C)[C@@H]1C=C(C=C[C@H]1[C@H]2C=CC(=C[CH:20]2[CH:10]3[CH:11]=[CH:12][C+:13](C=C3)C(C)C)C(C)C)C(C)C
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(C)[C@@H]1C=C(C=C[C@H]1[C@H]2C=CC(=C[CH+:20]2)C(C)C)C(C)C.CC(C)[C:13]1=[CH:12][CH:11]=[CH:10]C=C1>>CC(C)[C@@H]1C=C(C=C[C@H]1[C@H]2C=CC(=C[CH:20]2[CH:10]3[CH:11]=[CH:12][C+:13](C=C3)C(C)C)C(C)C)C(C)C 10,11=10,20;12,13=11,12

Priority: 2000

CC(C)[C@@H]1C=C(C=C[C@H]1[C@H]2C=CC(=C[CH+:20]2)C(C)C)C(C)C.CC(C)C1=C[CH:10]=[CH:11]C=C1>>CC(C)[C@@H]1C=C(C=C[C@H]1[C@H]2C=CC(=C[CH:20]2[CH:10]3C=C(C=C[CH+:11]3)C(C)C)C(C)C)C(C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C(C=C[C@H]1[C@H]2C=CC(=C[CH+:20]2)C(C)C)C(C)C.CC(C)C1=C[CH:10]=[CH:11]C=C1>>CC(C)[C@@H]1C=C(C=C[C@H]1[C@H]2C=CC(=C[CH:20]2[CH:10]3C=C(C=C[CH+:11]3)C(C)C)C(C)C)C(C)C 10,11=10,20

Reagent: 3
Reactant Smiles: CC(C)[C@H]1C=CC=C([C@@H]1C2C=C[C+](C=C2)Br)Br.C1=CC=C(C=C1)Br
Highest priority first:

Priority: 2600

CC(C)[C@H]1C=CC=C([C@@H]1C2C=C[C+:20](C=C2)Br)Br.C1=C[CH:10]=[C:11](C=C1)Br>>CC(C)[C@H]1C=CC=C([C@@H]1C2C=C[C:20](C=C2)([CH:10]3C=CC=C[C+:11]3Br)Br)Br
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC=C([C@@H]1C2C=C[C+:20](C=C2)Br)Br.C1=C[CH:10]=[C:11](C=C1)Br>>CC(C)[C@H]1C=CC=C([C@@H]1C2C=C[C:20](C=C2)([CH:10]3C=CC=C[C+:11]3Br)Br)Br 10,11=10,20

Priority: 2000

CC(C)[C@H]1C=CC=C([C@@H]1C2C=C[C+:20](C=C2)Br)Br.C1=CC=C([CH:11]=[CH:10]1)Br>>CC(C)[C@H]1C=CC=C([C@@H]1C2C=C[C:20](C=C2)([CH:10]3C=CC=C([CH+:11]3)Br)Br)Br
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC=C([C@@H]1C2C=C[C+:20](C=C2)Br)Br.C1=CC=C([CH:11]=[CH:10]1)Br>>CC(C)[C@H]1C=CC=C([C@@H]1C2C=C[C:20](C=C2)([CH:10]3C=CC=C([CH+:11]3)Br)Br)Br 10,11=10,20

Reagent: 16
Reactant Smiles: CC(=O)CC[C@H]1[C@@H](C[C@@](O1)(C)[O-])C=O
Highest priority first:

Priority: 6974

CC(=O)CC[C@H]1[C@@H](C[C@@:20]([O:21]1)(C)[O-:10])C=O>>CC(=O)CC[C@@H]([C@@H](C[C@:20](=[O:10])C)C=O)[O-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CC(=O)CC[C@H]1[C@@H](C[C@@:20]([O:21]1)(C)[O-:10])C=O>>CC(=O)CC[C@@H]([C@@H](C[C@:20](=[O:10])C)C=O)[O-:21] 10=20;20,21=21

Priority: 4446

CC(=O)CC[C@H]1[C@@H](C[C@@](O1)(C)[O-:10])[CH:20]=[O:21]>>CC(=O)CC[C@H]1[C@H]2C[C@](O1)([O:10][CH:20]2[O-:21])C
( 5 sp3 None 2 1 pi 2 2 )
n_O > π^*_C=O CC(=O)CC[C@H]1[C@@H](C[C@@](O1)(C)[O-:10])[CH:20]=[O:21]>>CC(=O)CC[C@H]1[C@H]2C[C@](O1)([O:10][CH:20]2[O-:21])C 10=20;20,21=21

Reagent: 3
Reactant Smiles: COC[C@H]1[C@@H]2C=CC=C[C@@]2([C@@H]3[C+]1C=CC=C3)/C=C/OC.CO/C=C/C1=CC=CC=C1
Highest priority first:

Priority: 2500

COC[C@H]1[C@@H]2C=CC=C[C@@]2([C@@H]3[C+:20]1C=CC=C3)/C=C/OC.CO/C=C/[C:11]1=[CH:10]C=CC=C1>>COC[C@H]1[C@@H]2C=CC=C[C@@]2([C@@H]3[C:20]1(C=CC=C3)[CH:10]4C=CC=C[C+:11]4/C=C/OC)/C=C/OC
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C COC[C@H]1[C@@H]2C=CC=C[C@@]2([C@@H]3[C+:20]1C=CC=C3)/C=C/OC.CO/C=C/[C:11]1=[CH:10]C=CC=C1>>COC[C@H]1[C@@H]2C=CC=C[C@@]2([C@@H]3[C:20]1(C=CC=C3)[CH:10]4C=CC=C[C+:11]4/C=C/OC)/C=C/OC 10,11=10,20

Priority: 2000

COC[C@H]1[C@@H]2C=CC=C[C@@]2([C@@H]3[C+:20]1C=CC=C3)/C=C/OC.CO/C=C/C1=C[CH:10]=[CH:11]C=C1>>COC[C@H]1[C@@H]2C=CC=C[C@@]2([C@@H]3[C:20]1(C=CC=C3)[CH:10]4C=C(C=C[CH+:11]4)/C=C/OC)/C=C/OC
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C COC[C@H]1[C@@H]2C=CC=C[C@@]2([C@@H]3[C+:20]1C=CC=C3)/C=C/OC.CO/C=C/C1=C[CH:10]=[CH:11]C=C1>>COC[C@H]1[C@@H]2C=CC=C[C@@]2([C@@H]3[C:20]1(C=CC=C3)[CH:10]4C=C(C=C[CH+:11]4)/C=C/OC)/C=C/OC 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=CC(=C4[C+]3C=CC=C4)[N+](=O)[O-])cccc2[N+](=O)[O-].c1ccc2=C(C=CC=c2c1)[N+](=O)[O-]
Highest priority first:

Priority: 2801

CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=CC(=C4[C+:20]3C=CC=C4)[N+](=O)[O-])cccc2[N+](=O)[O-].c1ccc2=C([CH:11]=[CH:10]C=c2c1)[N+](=O)[O-]>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=CC(=C4[C:20]3(C=CC=C4)[CH:10]5C=c6ccccc6=C([CH+:11]5)[N+](=O)[O-])[N+](=O)[O-])cccc2[N+](=O)[O-]
( 3 pi 2 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=CC(=C4[C+:20]3C=CC=C4)[N+](=O)[O-])cccc2[N+](=O)[O-].c1ccc2=C([CH:11]=[CH:10]C=c2c1)[N+](=O)[O-]>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=CC(=C4[C:20]3(C=CC=C4)[CH:10]5C=c6ccccc6=C([CH+:11]5)[N+](=O)[O-])[N+](=O)[O-])cccc2[N+](=O)[O-] 10,11=10,20

Priority: 2000

CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=CC(=C4[C+:20]3C=CC=C4)[N+](=O)[O-])cccc2[N+](=O)[O-].c1ccc2=C([CH:11]=[CH:10]C=c2c1)[N+](=O)[O-]>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=CC(=C4[C:20]3(C=CC=C4)[CH:10]5C=c6ccccc6=C([CH+:11]5)[N+](=O)[O-])[N+](=O)[O-])cccc2[N+](=O)[O-]
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=CC(=C4[C+:20]3C=CC=C4)[N+](=O)[O-])cccc2[N+](=O)[O-].c1ccc2=C([CH:11]=[CH:10]C=c2c1)[N+](=O)[O-]>>CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=CC(=C4[C:20]3(C=CC=C4)[CH:10]5C=c6ccccc6=C([CH+:11]5)[N+](=O)[O-])[N+](=O)[O-])cccc2[N+](=O)[O-] 10,11=10,20

Reagent: 16
Reactant Smiles: CCO[C@@](/C=C(/Cc1ccccc1)\O)([O-])OC(=O)c2ccccc2
Highest priority first:

Priority: 6983 $CCO[C@@:20](/C=C(/Cc1ccccc1)\O)([O-:10])[O:21]C(=O)c2ccccc2>>CCO[C@@:20](=[O:10])/C=C(/Cc1ccccc1)\O.c1ccc(cc1)C(=O)[O-:21]$
CCO[C@@:20](/C=C(/Cc1ccccc1)\O)([O-:10])[O:21]C(=O)c2ccccc2>>CCO[C@@:20](=[O:10])/C=C(/Cc1ccccc1)\O.c1ccc(cc1)C(=O)[O-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CCO[C@@:20](/C=C(/Cc1ccccc1)\O)([O-:10])[O:21]C(=O)c2ccccc2>>CCO[C@@:20](=[O:10])/C=C(/Cc1ccccc1)\O.c1ccc(cc1)C(=O)[O-:21] 10=20;20,21=21

Priority: 6975 $CC[O:21][C@@:20](/C=C(/Cc1ccccc1)\O)([O-:10])OC(=O)c2ccccc2>>CC[O-:21].c1ccc(cc1)C/C(=C/[C@@:20](=[O:10])OC(=O)c2ccccc2)/O$
CC[O:21][C@@:20](/C=C(/Cc1ccccc1)\O)([O-:10])OC(=O)c2ccccc2>>CC[O-:21].c1ccc(cc1)C/C(=C/[C@@:20](=[O:10])OC(=O)c2ccccc2)/O
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CC[O:21][C@@:20](/C=C(/Cc1ccccc1)\O)([O-:10])OC(=O)c2ccccc2>>CC[O-:21].c1ccc(cc1)C/C(=C/[C@@:20](=[O:10])OC(=O)c2ccccc2)/O 10=20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=Cc2cccc(c2[CH+]1)C#N.CC(C)[C@H]1C=CC2=CC=CC(=C2[CH+]1)C#N
Highest priority first:

Priority: 2731

CC(C)[C@H]1C=Cc2cccc(c2[CH+:20]1)C#N.CC(C)[C@H]1C=CC2=C[CH:10]=[CH:11]C(=C2[CH+]1)C#N>>CC(C)[C@H]1C=CC2=C[CH:10]([CH+:11]C(=C2[CH+]1)C#N)[CH:20]3c4c(cccc4C#N)C=C[C@@H]3C(C)C
( 3 pi 2 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=Cc2cccc(c2[CH+:20]1)C#N.CC(C)[C@H]1C=CC2=C[CH:10]=[CH:11]C(=C2[CH+]1)C#N>>CC(C)[C@H]1C=CC2=C[CH:10]([CH+:11]C(=C2[CH+]1)C#N)[CH:20]3c4c(cccc4C#N)C=C[C@@H]3C(C)C 10,11=10,20

Priority: 2500

CC(C)[C@H]1C=Cc2cccc(c2[CH+:20]1)C#N.CC(C)[C@H]1C=C[C:11]2=[CH:10]C=CC(=C2[CH+]1)C#N>>CC(C)[C@H]1C=C[C+:11]2[CH:10](C=CC(=C2[CH+]1)C#N)[CH:20]3c4c(cccc4C#N)C=C[C@@H]3C(C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=Cc2cccc(c2[CH+:20]1)C#N.CC(C)[C@H]1C=C[C:11]2=[CH:10]C=CC(=C2[CH+]1)C#N>>CC(C)[C@H]1C=C[C+:11]2[CH:10](C=CC(=C2[CH+]1)C#N)[CH:20]3c4c(cccc4C#N)C=C[C@@H]3C(C)C 10,11=10,20

Priority: 2000

CC(C)[C@H]1C=Cc2cccc(c2[CH+:20]1)C#N.CC(C)[C@H]1C=CC2=C[CH:10]=[CH:11]C(=C2[CH+]1)C#N>>CC(C)[C@H]1C=CC2=C[CH:10]([CH+:11]C(=C2[CH+]1)C#N)[CH:20]3c4c(cccc4C#N)C=C[C@@H]3C(C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=Cc2cccc(c2[CH+:20]1)C#N.CC(C)[C@H]1C=CC2=C[CH:10]=[CH:11]C(=C2[CH+]1)C#N>>CC(C)[C@H]1C=CC2=C[CH:10]([CH+:11]C(=C2[CH+]1)C#N)[CH:20]3c4c(cccc4C#N)C=C[C@@H]3C(C)C 10,11=10,20

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC=C([CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]
Highest priority first:

Priority: 2955

c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC=C([CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C([CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC=C([CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C([CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC=C([CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C([CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC=C([CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C([CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC=C([CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C([CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC=C([CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C([CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC=C([CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C([CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC=C([CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC=C([CH+]4)/N=N/[C@@H]5[CH+]C=CS5.[Cl-] 10,11=10,20;20,21=21

Reagent: 140
Reactant Smiles: [1H]CC(=O)[C@@H](C(=O)Cc1ccccc1)[C@@](Cc2ccccc2)(CC(=O)C)O.CC[O-]
Highest priority first:

Priority: 4386

[H:20][CH2:21][C:22](=[O:23])[C@@H](C(=O)Cc1ccccc1)[C@@](Cc2ccccc2)(CC(=O)C)O.CC[O-:10]>>[H:20][O:10]CC.CC(=O)C[C@](Cc1ccccc1)([C@@H]([C:22](=[CH2:21])[O-:23])C(=O)Cc2ccccc2)O
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH2:21][C:22](=[O:23])[C@@H](C(=O)Cc1ccccc1)[C@@](Cc2ccccc2)(CC(=O)C)O.CC[O-:10]>>[H:20][O:10]CC.CC(=O)C[C@](Cc1ccccc1)([C@@H]([C:22](=[CH2:21])[O-:23])C(=O)Cc2ccccc2)O 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][CH2:21]C(=O)[C@@H](C(=O)Cc1ccccc1)[C@@](Cc2ccccc2)(CC(=O)C)O.CC[O-:10]>>[H:20][O:10]CC.CC(=O)C[C@](Cc1ccccc1)([C@@H](C(=O)[CH2-:21])C(=O)Cc2ccccc2)O
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH2:21]C(=O)[C@@H](C(=O)Cc1ccccc1)[C@@](Cc2ccccc2)(CC(=O)C)O.CC[O-:10]>>[H:20][O:10]CC.CC(=O)C[C@](Cc1ccccc1)([C@@H](C(=O)[CH2-:21])C(=O)Cc2ccccc2)O 10=20;20,21=21

Reagent: 16
Reactant Smiles: [1H]C(C[C@@]1([C@@H](CC(=O)O1)C(=O)C)C)C(=O)OCC.C[O-].[Na+]
Highest priority first:

Priority: 4386

[H:20][CH:21](C[C@@]1([C@@H](CC(=O)O1)C(=O)C)C)[C:22](=[O:23])OCC.C[O-:10].[Na+]>>[H:20][O:10]C.CCO[C:22](=[CH:21]C[C@@]1([C@@H](CC(=O)O1)C(=O)C)C)[O-:23].[Na+]
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH:21](C[C@@]1([C@@H](CC(=O)O1)C(=O)C)C)[C:22](=[O:23])OCC.C[O-:10].[Na+]>>[H:20][O:10]C.CCO[C:22](=[CH:21]C[C@@]1([C@@H](CC(=O)O1)C(=O)C)C)[O-:23].[Na+] 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][CH:21](C[C@@]1([C@@H](CC(=O)O1)C(=O)C)C)C(=O)OCC.C[O-:10].[Na+]>>[H:20][O:10]C.CCOC(=O)[CH-:21]C[C@@]1([C@@H](CC(=O)O1)C(=O)C)C.[Na+]
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH:21](C[C@@]1([C@@H](CC(=O)O1)C(=O)C)C)C(=O)OCC.C[O-:10].[Na+]>>[H:20][O:10]C.CCOC(=O)[CH-:21]C[C@@]1([C@@H](CC(=O)O1)C(=O)C)C.[Na+] 10=20;20,21=21

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)N.[Cl-]
Highest priority first:

Priority: 2955

c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@H]5C=CC(=C[CH+]5)N.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@H]5C=CC(=C[CH+]5)N.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@H]5C=CC(=C[CH+]5)N.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@H]5C=CC(=C[CH+]5)N.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@H]5C=CC(=C[CH+]5)N.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@H]5C=CC(=C[CH+]5)N.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@H]5C=CC(=C[CH+]5)N.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@H]4C=CC(=C[CH+]4)/N=N/[C@H]5C=CC(=C[CH+]5)N.[Cl-] 10,11=10,20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH+]2)[C@@H](C)OS(=O)(=O)C(F)(F)F)[C@@H](C)OS(=O)(=O)C(F)(F)F
Highest priority first:

Priority: 7084

CC(C)[C@@H]1[CH:11]=[C:10](C=C[C@@H]1[C@H]2C=CC=C([CH+:20]2)[C@@H](C)OS(=O)(=O)C(F)(F)F)[C@@H](C)OS(=O)(=O)C(F)(F)F>>CC(C)[C@@H]1[CH+:11][C:10]2(C=C[C@@H]1[C@@H]3[CH:20]2C(=CC=C3)[C@@H](C)OS(=O)(=O)C(F)(F)F)[C@@H](C)OS(=O)(=O)C(F)(F)F
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH:11]=[C:10](C=C[C@@H]1[C@H]2C=CC=C([CH+:20]2)[C@@H](C)OS(=O)(=O)C(F)(F)F)[C@@H](C)OS(=O)(=O)C(F)(F)F>>CC(C)[C@@H]1[CH+:11][C:10]2(C=C[C@@H]1[C@@H]3[CH:20]2C(=CC=C3)[C@@H](C)OS(=O)(=O)C(F)(F)F)[C@@H](C)OS(=O)(=O)C(F)(F)F 10,11=10,20

Priority: 7082

CC(C)[C@@H]1C=C([CH:10]=[CH:11][C@@H]1[C@H]2C=CC=C([CH+:20]2)[C@@H](C)OS(=O)(=O)C(F)(F)F)[C@@H](C)OS(=O)(=O)C(F)(F)F>>CC(C)[C@@H]1C=C([CH:10]2[CH+:11][C@@H]1[C@@H]3[CH:20]2C(=CC=C3)[C@@H](C)OS(=O)(=O)C(F)(F)F)[C@@H](C)OS(=O)(=O)C(F)(F)F
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C([CH:10]=[CH:11][C@@H]1[C@H]2C=CC=C([CH+:20]2)[C@@H](C)OS(=O)(=O)C(F)(F)F)[C@@H](C)OS(=O)(=O)C(F)(F)F>>CC(C)[C@@H]1C=C([CH:10]2[CH+:11][C@@H]1[C@@H]3[CH:20]2C(=CC=C3)[C@@H](C)OS(=O)(=O)C(F)(F)F)[C@@H](C)OS(=O)(=O)C(F)(F)F 10,11=10,20

Reagent: 3
Reactant Smiles: C[C@@H](Cc1ccccc1)[C@@H]2C=CC=C[C@@]2(CC=C)[C@@H]3C=C(C=C[CH+]3)CC=C.C[C@@H](CC1=CC=CC=C1)[C@@H]2C=CC=C[C@@]2(CC=C)[C@@H]3C=C(C=C[CH+]3)CC=C
Highest priority first:

Priority: 2500

C[C@@H](Cc1ccccc1)[C@@H]2C=CC=C[C@@]2(CC=C)[C@@H]3C=C(C=C[CH+:20]3)CC=C.C[C@@H](C[C:11]1=[CH:10]C=CC=C1)[C@@H]2C=CC=C[C@@]2(CC=C)[C@@H]3C=C(C=C[CH+]3)CC=C>>C[C@@H](Cc1ccccc1)[C@@H]2C=CC=C[C@@]2(CC=C)[C@@H]3C=C(C=C[CH:20]3[CH:10]4C=CC=C[C+:11]4C[C@H](C)[C@@H]5C=CC=C[C@@]5(CC=C)[C@@H]6C=C(C=C[CH+]6)CC=C)CC=C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C@@H](Cc1ccccc1)[C@@H]2C=CC=C[C@@]2(CC=C)[C@@H]3C=C(C=C[CH+:20]3)CC=C.C[C@@H](C[C:11]1=[CH:10]C=CC=C1)[C@@H]2C=CC=C[C@@]2(CC=C)[C@@H]3C=C(C=C[CH+]3)CC=C>>C[C@@H](Cc1ccccc1)[C@@H]2C=CC=C[C@@]2(CC=C)[C@@H]3C=C(C=C[CH:20]3[CH:10]4C=CC=C[C+:11]4C[C@H](C)[C@@H]5C=CC=C[C@@]5(CC=C)[C@@H]6C=C(C=C[CH+]6)CC=C)CC=C 10,11=10,20

Priority: 2000

C[C@@H](Cc1ccccc1)[C@@H]2C=CC=C[C@@]2(CC=C)[C@@H]3C=C(C=C[CH+:20]3)CC=C.C[C@@H](CC1=C[CH:10]=[CH:11]C=C1)[C@@H]2C=CC=C[C@@]2(CC=C)[C@@H]3C=C(C=C[CH+]3)CC=C>>C[C@@H](Cc1ccccc1)[C@@H]2C=CC=C[C@@]2(CC=C)[C@@H]3C=C(C=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)C[C@H](C)[C@@H]5C=CC=C[C@@]5(CC=C)[C@@H]6C=C(C=C[CH+]6)CC=C)CC=C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C C[C@@H](Cc1ccccc1)[C@@H]2C=CC=C[C@@]2(CC=C)[C@@H]3C=C(C=C[CH+:20]3)CC=C.C[C@@H](CC1=C[CH:10]=[CH:11]C=C1)[C@@H]2C=CC=C[C@@]2(CC=C)[C@@H]3C=C(C=C[CH+]3)CC=C>>C[C@@H](Cc1ccccc1)[C@@H]2C=CC=C[C@@]2(CC=C)[C@@H]3C=C(C=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)C[C@H](C)[C@@H]5C=CC=C[C@@]5(CC=C)[C@@H]6C=C(C=C[CH+]6)CC=C)CC=C 10,11=10,20

Reagent: 28
Reactant Smiles: COC1=CC=CC=C1.c1ccc(cc1)C(=O)[C@H]2C=C(C=C[CH+]2)C(=O)Cl
Highest priority first:

Priority: 2950

CO[C:11]1=[CH:10]C=CC=C1.c1ccc(cc1)C(=O)[C@H]2C=C(C=C[CH+:20]2)C(=O)Cl>>CO[C+:11]1C=CC=C[CH:10]1[CH:20]2C=CC(=C[C@@H]2C(=O)c3ccccc3)C(=O)Cl
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CO[C:11]1=[CH:10]C=CC=C1.c1ccc(cc1)C(=O)[C@H]2C=C(C=C[CH+:20]2)C(=O)Cl>>CO[C+:11]1C=CC=C[CH:10]1[CH:20]2C=CC(=C[C@@H]2C(=O)c3ccccc3)C(=O)Cl 10,11=10,20

Priority: 2000

COC1=C[CH:10]=[CH:11]C=C1.c1ccc(cc1)C(=O)[C@H]2C=C(C=C[CH+:20]2)C(=O)Cl>>COC1=C[CH:10]([CH+:11]C=C1)[CH:20]2C=CC(=C[C@@H]2C(=O)c3ccccc3)C(=O)Cl
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C COC1=C[CH:10]=[CH:11]C=C1.c1ccc(cc1)C(=O)[C@H]2C=C(C=C[CH+:20]2)C(=O)Cl>>COC1=C[CH:10]([CH+:11]C=C1)[CH:20]2C=CC(=C[C@@H]2C(=O)c3ccccc3)C(=O)Cl 10,11=10,20

Reagent: 3
Reactant Smiles: CC[C@H](c1ccccc1)[C@H]2C=CC=C([C@H]2[C@H]3C=CC=C([CH+]3)/C=C/C)/C=C/C.CC[C@@H]([C@H]1C=CC=C([C@H]1[C@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)C3=CC=CC=C3
Highest priority first:

Priority: 2500

CC[C@H](c1ccccc1)[C@H]2C=CC=C([C@H]2[C@H]3C=CC=C([CH+:20]3)/C=C/C)/C=C/C.CC[C@@H]([C@H]1C=CC=C([C@H]1[C@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)[C:13]3=[CH:12][CH:11]=[CH:10]C=C3>>CC[C@H](c1ccccc1)[C@H]2C=CC=C([C@H]2[C@H]3C=CC=C([CH:20]3[CH:10]4[CH:11]=[CH:12][C+:13](C=C4)[C@@H](CC)[C@H]5C=CC=C([C@H]5[C@H]6C=CC=C([CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC[C@H](c1ccccc1)[C@H]2C=CC=C([C@H]2[C@H]3C=CC=C([CH+:20]3)/C=C/C)/C=C/C.CC[C@@H]([C@H]1C=CC=C([C@H]1[C@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)[C:13]3=[CH:12][CH:11]=[CH:10]C=C3>>CC[C@H](c1ccccc1)[C@H]2C=CC=C([C@H]2[C@H]3C=CC=C([CH:20]3[CH:10]4[CH:11]=[CH:12][C+:13](C=C4)[C@@H](CC)[C@H]5C=CC=C([C@H]5[C@H]6C=CC=C([CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C 10,11=10,20;12,13=11,12

Priority: 2000

CC[C@H](c1ccccc1)[C@H]2C=CC=C([C@H]2[C@H]3C=CC=C([CH+:20]3)/C=C/C)/C=C/C.CC[C@@H]([C@H]1C=CC=C([C@H]1[C@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)C3=C[CH:10]=[CH:11]C=C3>>CC[C@H](c1ccccc1)[C@H]2C=CC=C([C@H]2[C@H]3C=CC=C([CH:20]3[CH:10]4C=C(C=C[CH+:11]4)[C@@H](CC)[C@H]5C=CC=C([C@H]5[C@H]6C=CC=C([CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC[C@H](c1ccccc1)[C@H]2C=CC=C([C@H]2[C@H]3C=CC=C([CH+:20]3)/C=C/C)/C=C/C.CC[C@@H]([C@H]1C=CC=C([C@H]1[C@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)C3=C[CH:10]=[CH:11]C=C3>>CC[C@H](c1ccccc1)[C@H]2C=CC=C([C@H]2[C@H]3C=CC=C([CH:20]3[CH:10]4C=C(C=C[CH+:11]4)[C@@H](CC)[C@H]5C=CC=C([C@H]5[C@H]6C=CC=C([CH+]6)/C=C/C)/C=C/C)/C=C/C)/C=C/C 10,11=10,20

Reagent: 3
Reactant Smiles: CC(C)[C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH+]2)C(C)C)C(C)C.CC(C)C1=CC=CC=C1
Highest priority first:

Priority: 2500

CC(C)[C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH+:20]2)C(C)C)C(C)C.CC(C)[C:13]1=[CH:12][CH:11]=[CH:10]C=C1>>CC(C)[C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH:20]2[CH:10]3[CH:11]=[CH:12][C+:13](C=C3)C(C)C)C(C)C)C(C)C
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(C)[C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH+:20]2)C(C)C)C(C)C.CC(C)[C:13]1=[CH:12][CH:11]=[CH:10]C=C1>>CC(C)[C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH:20]2[CH:10]3[CH:11]=[CH:12][C+:13](C=C3)C(C)C)C(C)C)C(C)C 10,11=10,20;12,13=11,12

Priority: 2000

CC(C)[C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH+:20]2)C(C)C)C(C)C.CC(C)C1=C[CH:10]=[CH:11]C=C1>>CC(C)[C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH:20]2[CH:10]3C=C(C=C[CH+:11]3)C(C)C)C(C)C)C(C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH+:20]2)C(C)C)C(C)C.CC(C)C1=C[CH:10]=[CH:11]C=C1>>CC(C)[C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH:20]2[CH:10]3C=C(C=C[CH+:11]3)C(C)C)C(C)C)C(C)C 10,11=10,20

Reagent: 3
Reactant Smiles: C[C@H]1CCCC[C@@]2([C@@H]1C=CC=C2)[C@H]3C=CC=C[C+]3CCCCC=C
Highest priority first:

Priority: 7084

C[C@H]1CCCC[C@@]2([C@@H]1[CH:11]=[CH:10]C=C2)[C@H]3C=CC=C[C+:20]3CCCCC=C>>C[C@H]1CCCC[C@]23[C@@H]1[CH+:11][CH:10](C=C2)[C:20]4([C@@H]3C=CC=C4)CCCCC=C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C C[C@H]1CCCC[C@@]2([C@@H]1[CH:11]=[CH:10]C=C2)[C@H]3C=CC=C[C+:20]3CCCCC=C>>C[C@H]1CCCC[C@]23[C@@H]1[CH+:11][CH:10](C=C2)[C:20]4([C@@H]3C=CC=C4)CCCCC=C 10,11=10,20

Priority: 7082

C[C@H]1CCCC[C@@]2([C@@H]1C=C[CH:10]=[CH:11]2)[C@H]3C=CC=C[C+:20]3CCCCC=C>>C[C@H]1CCCC[C@]23[C@@H]1C=C[CH:10]([CH+:11]2)[C:20]4([C@@H]3C=CC=C4)CCCCC=C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C C[C@H]1CCCC[C@@]2([C@@H]1C=C[CH:10]=[CH:11]2)[C@H]3C=CC=C[C+:20]3CCCCC=C>>C[C@H]1CCCC[C@]23[C@@H]1C=C[CH:10]([CH+:11]2)[C:20]4([C@@H]3C=CC=C4)CCCCC=C 10,11=10,20

Priority: 7030

C[C@H]1CCCC[C@@]2([C@@H]1C=CC=C2)[C@H]3C=C[CH:11]=[CH:10][C+:20]3CCCCC=C>>C[C@H]1CCCC[C@@]2([C@@H]1C=CC=C2)[C@H]3C=C[CH+:11][CH:10]=[C:20]3CCCCC=C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C C[C@H]1CCCC[C@@]2([C@@H]1C=CC=C2)[C@H]3C=C[CH:11]=[CH:10][C+:20]3CCCCC=C>>C[C@H]1CCCC[C@@]2([C@@H]1C=CC=C2)[C@H]3C=C[CH+:11][CH:10]=[C:20]3CCCCC=C 10,11=10,20

Reagent: 87
Reactant Smiles: [1H]C(C(=O)Cc1ccccc1)[C@]2(CC(=O)C[C@@](O2)(Cc3ccccc3)O)C.[OH-]
Highest priority first:

Priority: 4386

[H:20][CH:21]([C:22](=[O:23])Cc1ccccc1)[C@]2(CC(=O)C[C@@](O2)(Cc3ccccc3)O)C.[OH-:10]>>[H:20][OH:10].C[C@@]1(CC(=O)C[C@@](O1)(Cc2ccccc2)O)[CH:21]=[C:22](Cc3ccccc3)[O-:23]
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH:21]([C:22](=[O:23])Cc1ccccc1)[C@]2(CC(=O)C[C@@](O2)(Cc3ccccc3)O)C.[OH-:10]>>[H:20][OH:10].C[C@@]1(CC(=O)C[C@@](O1)(Cc2ccccc2)O)[CH:21]=[C:22](Cc3ccccc3)[O-:23] 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][CH:21](C(=O)Cc1ccccc1)[C@]2(CC(=O)C[C@@](O2)(Cc3ccccc3)O)C.[OH-:10]>>[H:20][OH:10].C[C@@]1(CC(=O)C[C@@](O1)(Cc2ccccc2)O)[CH-:21]C(=O)Cc3ccccc3
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH:21](C(=O)Cc1ccccc1)[C@]2(CC(=O)C[C@@](O2)(Cc3ccccc3)O)C.[OH-:10]>>[H:20][OH:10].C[C@@]1(CC(=O)C[C@@](O1)(Cc2ccccc2)O)[CH-:21]C(=O)Cc3ccccc3 10=20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=C(C=C2[C@@]1(C=CC=C2)[C@@H]3C=C(C=C4[C+]3C=CC=C4)C(F)(F)F)C(F)(F)F
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[C:10](C=C2[C@@]1(C=CC=C2)[C@@H]3C=C(C=C4[C+:20]3C=CC=C4)C(F)(F)F)C(F)(F)F>>CC(C)[C@H]1[CH+:11][C:10]2(C=C3[C@@]1(C=CC=C3)[C@H]4[C:20]25C=CC=CC5=CC(=C4)C(F)(F)F)C(F)(F)F
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[C:10](C=C2[C@@]1(C=CC=C2)[C@@H]3C=C(C=C4[C+:20]3C=CC=C4)C(F)(F)F)C(F)(F)F>>CC(C)[C@H]1[CH+:11][C:10]2(C=C3[C@@]1(C=CC=C3)[C@H]4[C:20]25C=CC=CC5=CC(=C4)C(F)(F)F)C(F)(F)F 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=C(C=C2[C@@]1([CH:11]=[CH:10]C=C2)[C@@H]3C=C(C=C4[C+:20]3C=CC=C4)C(F)(F)F)C(F)(F)F>>CC(C)[C@H]1C=C(C=C2[C@]13[CH+:11][CH:10](C=C2)[C:20]45[C@H]3C=C(C=C4C=CC=C5)C(F)(F)F)C(F)(F)F
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=C(C=C2[C@@]1([CH:11]=[CH:10]C=C2)[C@@H]3C=C(C=C4[C+:20]3C=CC=C4)C(F)(F)F)C(F)(F)F>>CC(C)[C@H]1C=C(C=C2[C@]13[CH+:11][CH:10](C=C2)[C:20]45[C@H]3C=C(C=C4C=CC=C5)C(F)(F)F)C(F)(F)F 10,11=10,20

Reagent: 27
Reactant Smiles: CCO[C@](C(Cc1ccccc1)([C@@]([OH2+])(O)OCC)N[C@@](C)([OH2+])O)([OH2+])O
Highest priority first:

Priority: 6973

CCO[C@](C(Cc1ccccc1)([C@@]([OH2+])(O)OCC)N[C@@:20](C)([OH2+:21])[OH:10])([OH2+])O>>CCO[C@](C(Cc1ccccc1)([C@@]([OH2+])(O)OCC)N[C@@:20](=[OH+:10])C)([OH2+])O.[OH2:21]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-O CCO[C@](C(Cc1ccccc1)([C@@]([OH2+])(O)OCC)N[C@@:20](C)([OH2+:21])[OH:10])([OH2+])O>>CCO[C@](C(Cc1ccccc1)([C@@]([OH2+])(O)OCC)N[C@@:20](=[OH+:10])C)([OH2+])O.[OH2:21] 10=20;20,21=21

Priority: 6972

CCO[C@](C(Cc1ccccc1)([C@@]([OH2+])(O)OCC)[NH:10][C@@:20](C)([OH2+:21])O)([OH2+])O>>CCO[C@](C(Cc1ccccc1)([C@@]([OH2+])(O)OCC)[NH+:10]=[C@@:20](C)O)([OH2+])O.[OH2:21]
( 2 sp3 None 2 1 sigma 8 2 )
n_N > σ^*_C-O CCO[C@](C(Cc1ccccc1)([C@@]([OH2+])(O)OCC)[NH:10][C@@:20](C)([OH2+:21])O)([OH2+])O>>CCO[C@](C(Cc1ccccc1)([C@@]([OH2+])(O)OCC)[NH+:10]=[C@@:20](C)O)([OH2+])O.[OH2:21] 10=20;20,21=21

Priority: 6970

CCO[C@](C(Cc1ccccc1)([C@@:20]([OH2+:21])(O)[O:10]CC)N[C@@](C)([OH2+])O)([OH2+])O>>CCO[C@](C(Cc1ccccc1)([C@:20](=[O+:10]CC)O)N[C@@](C)([OH2+])O)([OH2+])O.[OH2:21]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-O CCO[C@](C(Cc1ccccc1)([C@@:20]([OH2+:21])(O)[O:10]CC)N[C@@](C)([OH2+])O)([OH2+])O>>CCO[C@](C(Cc1ccccc1)([C@:20](=[O+:10]CC)O)N[C@@](C)([OH2+])O)([OH2+])O.[OH2:21] 10=20;20,21=21

Priority: 4100

CCO[C@](C(Cc1ccccc1)([C@@:20]([OH2+:21])(O)OCC)N[C@@](C)([OH2+])O)([OH2+])O>>CCO[C@@+:20](C(Cc1ccccc1)([C@@]([OH2+])(O)OCC)N[C@@](C)([OH2+])O)O.[OH2:21]
( 1 sigma 2 2 1 sigma 2 2 )
σ_C-O > σ^*_C-O CCO[C@](C(Cc1ccccc1)([C@@:20]([OH2+:21])(O)OCC)N[C@@](C)([OH2+])O)([OH2+])O>>CCO[C@@+:20](C(Cc1ccccc1)([C@@]([OH2+])(O)OCC)N[C@@](C)([OH2+])O)O.[OH2:21] 20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=C(c2ccccc2[CH+]1)C(=O)C.CC(=O)C1=CC=Cc2c1cccc2
Highest priority first:

Priority: 2550

CC(C)[C@H]1C=C(c2ccccc2[CH+:20]1)C(=O)C.CC(=O)[C:13]1=[CH:12][CH:11]=[CH:10]c2c1cccc2>>CC(C)[C@H]1C=C(c2ccccc2[CH:20]1[CH:10]3[CH:11]=[CH:12][C+:13](c4c3cccc4)C(=O)C)C(=O)C
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(C)[C@H]1C=C(c2ccccc2[CH+:20]1)C(=O)C.CC(=O)[C:13]1=[CH:12][CH:11]=[CH:10]c2c1cccc2>>CC(C)[C@H]1C=C(c2ccccc2[CH:20]1[CH:10]3[CH:11]=[CH:12][C+:13](c4c3cccc4)C(=O)C)C(=O)C 10,11=10,20;12,13=11,12

Priority: 2500

CC(C)[C@H]1C=C(c2ccccc2[CH+:20]1)C(=O)C.CC(=O)[C:11]1=[CH:10]C=Cc2c1cccc2>>CC(C)[C@H]1C=C(c2ccccc2[CH:20]1[CH:10]3C=Cc4ccccc4[C+:11]3C(=O)C)C(=O)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=C(c2ccccc2[CH+:20]1)C(=O)C.CC(=O)[C:11]1=[CH:10]C=Cc2c1cccc2>>CC(C)[C@H]1C=C(c2ccccc2[CH:20]1[CH:10]3C=Cc4ccccc4[C+:11]3C(=O)C)C(=O)C 10,11=10,20

Priority: 2000

CC(C)[C@H]1C=C(c2ccccc2[CH+:20]1)C(=O)C.CC(=O)C1=C[CH:10]=[CH:11]c2c1cccc2>>CC(C)[C@H]1C=C(c2ccccc2[CH:20]1[CH:10]3C=C(c4ccccc4[CH+:11]3)C(=O)C)C(=O)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=C(c2ccccc2[CH+:20]1)C(=O)C.CC(=O)C1=C[CH:10]=[CH:11]c2c1cccc2>>CC(C)[C@H]1C=C(c2ccccc2[CH:20]1[CH:10]3C=C(c4ccccc4[CH+:11]3)C(=O)C)C(=O)C 10,11=10,20

Reagent: 3
Reactant Smiles: CC[C@H](c1ccccc1)[C@@H]2C=CC=C[C@]2(/C=C/C)[C@@H]3C=CC(=C[CH+]3)/C=C/C.C/C=C/C1=CC=CC=C1
Highest priority first:

Priority: 2500

CC[C@H](c1ccccc1)[C@@H]2C=CC=C[C@]2(/C=C/C)[C@@H]3C=CC(=C[CH+:20]3)/C=C/C.C/C=C/[C:11]1=[CH:10]C=CC=C1>>CC[C@H](c1ccccc1)[C@@H]2C=CC=C[C@]2(/C=C/C)[C@@H]3C=CC(=C[CH:20]3[CH:10]4C=CC=C[C+:11]4/C=C/C)/C=C/C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC[C@H](c1ccccc1)[C@@H]2C=CC=C[C@]2(/C=C/C)[C@@H]3C=CC(=C[CH+:20]3)/C=C/C.C/C=C/[C:11]1=[CH:10]C=CC=C1>>CC[C@H](c1ccccc1)[C@@H]2C=CC=C[C@]2(/C=C/C)[C@@H]3C=CC(=C[CH:20]3[CH:10]4C=CC=C[C+:11]4/C=C/C)/C=C/C 10,11=10,20

Priority: 2000

CC[C@H](c1ccccc1)[C@@H]2C=CC=C[C@]2(/C=C/C)[C@@H]3C=CC(=C[CH+:20]3)/C=C/C.C/C=C/C1=C[CH:10]=[CH:11]C=C1>>CC[C@H](c1ccccc1)[C@@H]2C=CC=C[C@]2(/C=C/C)[C@@H]3C=CC(=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)/C=C/C)/C=C/C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC[C@H](c1ccccc1)[C@@H]2C=CC=C[C@]2(/C=C/C)[C@@H]3C=CC(=C[CH+:20]3)/C=C/C.C/C=C/C1=C[CH:10]=[CH:11]C=C1>>CC[C@H](c1ccccc1)[C@@H]2C=CC=C[C@]2(/C=C/C)[C@@H]3C=CC(=C[CH:20]3[CH:10]4C=C(C=C[CH+:11]4)/C=C/C)/C=C/C 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=CC2=CC(=CC=C2[C@@H]1[C@@H]3C=CC=C4[C+]3C=C(C=C4)Br)Br
Highest priority first:

Priority: 2985

CC(C)[C@@H]1C=CC2=CC(=C[CH:10]=[C:11]2[C@@H]1[C@@H]3C=CC=C4[C+:20]3C=C(C=C4)Br)Br>>CC(C)[C@@H]1C=CC2=CC(=C[CH:10]3[C+:11]2[C@@H]1[C@H]4[C:20]35C=C(C=CC5=CC=C4)Br)Br
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=CC2=CC(=C[CH:10]=[C:11]2[C@@H]1[C@@H]3C=CC=C4[C+:20]3C=C(C=C4)Br)Br>>CC(C)[C@@H]1C=CC2=CC(=C[CH:10]3[C+:11]2[C@@H]1[C@H]4[C:20]35C=C(C=CC5=CC=C4)Br)Br 10,11=10,20

Priority: 2980

CC(C)[C@@H]1C=C[C:11]2=[CH:10]C(=CC=C2[C@@H]1[C@@H]3C=CC=C4[C+:20]3C=C(C=C4)Br)Br>>CC(C)[C@@H]1C=C[C+:11]2[CH:10]3C(=CC=C2[C@@H]1[C@H]4[C:20]35C=C(C=CC5=CC=C4)Br)Br
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C[C:11]2=[CH:10]C(=CC=C2[C@@H]1[C@@H]3C=CC=C4[C+:20]3C=C(C=C4)Br)Br>>CC(C)[C@@H]1C=C[C+:11]2[CH:10]3C(=CC=C2[C@@H]1[C@H]4[C:20]35C=C(C=CC5=CC=C4)Br)Br 10,11=10,20

Reagent: 66
Reactant Smiles: CC1=CC2=CC=C[C@H]([C+]2C=C1)[C@@]34C=C(C=CC3=CC=C[C@H]4C(C)C)C
Highest priority first:

Priority: 7084

CC1=CC2=CC=C[C@H]([C+:20]2C=C1)[C@@]34C=C(C=CC3=C[CH:10]=[CH:11][C@H]4C(C)C)C>>CC1=CC2=CC=C[C@@H]3[C:20]2(C=C1)[CH:10]4C=C5[C@@]3(C=C(C=C5)C)[C@@H]([CH+:11]4)C(C)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC1=CC2=CC=C[C@H]([C+:20]2C=C1)[C@@]34C=C(C=CC3=C[CH:10]=[CH:11][C@H]4C(C)C)C>>CC1=CC2=CC=C[C@@H]3[C:20]2(C=C1)[CH:10]4C=C5[C@@]3(C=C(C=C5)C)[C@@H]([CH+:11]4)C(C)C 10,11=10,20

Priority: 7082

CC1=CC2=CC=C[C@H]([C+:20]2C=C1)[C@@]34[CH:11]=[C:10](C=CC3=CC=C[C@H]4C(C)C)C>>CC1=CC2=CC=C[C@@H]3[C:20]2(C=C1)[C:10]4(C=CC5=CC=C[C@H]([C@@]35[CH+:11]4)C(C)C)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC1=CC2=CC=C[C@H]([C+:20]2C=C1)[C@@]34[CH:11]=[C:10](C=CC3=CC=C[C@H]4C(C)C)C>>CC1=CC2=CC=C[C@@H]3[C:20]2(C=C1)[C:10]4(C=CC5=CC=C[C@H]([C@@]35[CH+:11]4)C(C)C)C 10,11=10,20

Reagent: 16
Reactant Smiles: CCS[C@](C=C)(OC(=O)C)O[C@](C)([O-])OC(=O)C=C
Highest priority first:

Priority: 6983

CCS[C@](C=C)(OC(=O)C)O[C@:20](C)([O-:10])[O:21]C(=O)C=C>>CCS[C@](C=C)(OC(=O)C)O[C@:20](=[O:10])C.C=CC(=O)[O-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CCS[C@](C=C)(OC(=O)C)O[C@:20](C)([O-:10])[O:21]C(=O)C=C>>CCS[C@](C=C)(OC(=O)C)O[C@:20](=[O:10])C.C=CC(=O)[O-:21] 10=20;20,21=21

Priority: 6975

CCS[C@](C=C)(OC(=O)C)[O:21][C@:20](C)([O-:10])OC(=O)C=C>>CCS[C@@](C=C)([O-:21])OC(=O)C.C[C@:20](=[O:10])OC(=O)C=C
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CCS[C@](C=C)(OC(=O)C)[O:21][C@:20](C)([O-:10])OC(=O)C=C>>CCS[C@@](C=C)([O-:21])OC(=O)C.C[C@:20](=[O:10])OC(=O)C=C 10=20;20,21=21

Priority: 4448

CCS[C@](C=C)(O[C:20](=[O:21])C)O[C@](C)([O-:10])OC(=O)C=C>>CCS[C@@]1(O[C:20]([O:10][C@](O1)(C)OC(=O)C=C)(C)[O-:21])C=C
( 5 sp3 None 2 1 pi 2 2 )
n_O > π^*_C=O CCS[C@](C=C)(O[C:20](=[O:21])C)O[C@](C)([O-:10])OC(=O)C=C>>CCS[C@@]1(O[C:20]([O:10][C@](O1)(C)OC(=O)C=C)(C)[O-:21])C=C 10=20;20,21=21

Reagent: 8
Reactant Smiles: CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Priority: 2955

CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CO[C+]1C=CC(C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Reagent: 8
Reactant Smiles: [1H]CC(=O)[C@@H](CC(=O)[O-])C=O.C[O-].[Na+]
Highest priority first:

Priority: 4386

[H:20][CH2:21][C:22](=[O:23])[C@@H](CC(=O)[O-])C=O.C[O-:10].[Na+]>>[H:20][O:10]C.[CH2:21]=[C:22]([C@@H](CC(=O)[O-])C=O)[O-:23].[Na+]
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][CH2:21][C:22](=[O:23])[C@@H](CC(=O)[O-])C=O.C[O-:10].[Na+]>>[H:20][O:10]C.[CH2:21]=[C:22]([C@@H](CC(=O)[O-])C=O)[O-:23].[Na+] 10=20;20,21=21,22;22,23=23

Priority: 4371

[H:20][CH2:21]C(=O)[C@@H](CC(=O)[O-])C=O.C[O-:10].[Na+]>>[H:20][O:10]C.[CH2-:21]C(=O)[C@@H](CC(=O)[O-])C=O.[Na+]
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][CH2:21]C(=O)[C@@H](CC(=O)[O-])C=O.C[O-:10].[Na+]>>[H:20][O:10]C.[CH2-:21]C(=O)[C@@H](CC(=O)[O-])C=O.[Na+] 10=20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=c2c(=C[CH+]1)cccc2C(=O)C.CC(C)[C@H]1C=C2C(=C[CH+]1)C=CC=C2C(=O)C
Highest priority first:

Priority: 2741

CC(C)[C@H]1C=c2c(=C[CH+:20]1)cccc2C(=O)C.CC(C)[C@H]1C=C2C(=C[CH+]1)C=[CH:10][CH:11]=C2C(=O)C>>CC(C)[C@H]1C=c2c(=C[CH:20]1[CH:10]=CC3=C[CH+][C@H](C=C3C(=[CH+:11])C(=O)C)C(C)C)cccc2C(=O)C
( 3 sigma 2 2 5 p None 0 )
σ_C-C > p_C CC(C)[C@H]1C=c2c(=C[CH+:20]1)cccc2C(=O)C.CC(C)[C@H]1C=C2C(=C[CH+]1)C=[CH:10][CH:11]=C2C(=O)C>>CC(C)[C@H]1C=c2c(=C[CH:20]1[CH:10]=CC3=C[CH+][C@H](C=C3C(=[CH+:11])C(=O)C)C(C)C)cccc2C(=O)C 10,11=10,20

Priority: 2500

CC(C)[C@H]1C=c2c(=C[CH+:20]1)cccc2C(=O)C.CC(C)[C@H]1C=C2C(=C[CH+]1)C=C[CH:10]=[C:11]2C(=O)C>>CC(C)[C@H]1C=c2c(=C[CH:20]1[CH:10]3C=CC4=C[CH+][C@H](C=C4[C+:11]3C(=O)C)C(C)C)cccc2C(=O)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=c2c(=C[CH+:20]1)cccc2C(=O)C.CC(C)[C@H]1C=C2C(=C[CH+]1)C=C[CH:10]=[C:11]2C(=O)C>>CC(C)[C@H]1C=c2c(=C[CH:20]1[CH:10]3C=CC4=C[CH+][C@H](C=C4[C+:11]3C(=O)C)C(C)C)cccc2C(=O)C 10,11=10,20

Priority: 2000

CC(C)[C@H]1C=c2c(=C[CH+:20]1)cccc2C(=O)C.CC(C)[C@H]1C=C2C(=C[CH+]1)C=[CH:10][CH:11]=C2C(=O)C>>CC(C)[C@H]1C=c2c(=C[CH:20]1[CH:10]=CC3=C[CH+][C@H](C=C3C(=[CH+:11])C(=O)C)C(C)C)cccc2C(=O)C
( 2 sigma 1 2 5 p None 0 )
σ_C-C > p_C CC(C)[C@H]1C=c2c(=C[CH+:20]1)cccc2C(=O)C.CC(C)[C@H]1C=C2C(=C[CH+]1)C=[CH:10][CH:11]=C2C(=O)C>>CC(C)[C@H]1C=c2c(=C[CH:20]1[CH:10]=CC3=C[CH+][C@H](C=C3C(=[CH+:11])C(=O)C)C(C)C)cccc2C(=O)C 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH+]3)cc[nH]2.CC(C)[C@@H]1C=C2C(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH+]3)C=CN2
Highest priority first:

Priority: 2925

CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH+:20]3)cc[nH]2.CC(C)[C@@H]1C=C2C(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH+]3)[CH:11]=[CH:10]N2>>CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH:20]3[CH:10]5[CH+:11]C6=C[C@H]([C@@H](C=C6N5)C(C)C)[C@H]7C=Cc8cc[nH]c8[CH+]7)cc[nH]2
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH+:20]3)cc[nH]2.CC(C)[C@@H]1C=C2C(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH+]3)[CH:11]=[CH:10]N2>>CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH:20]3[CH:10]5[CH+:11]C6=C[C@H]([C@@H](C=C6N5)C(C)C)[C@H]7C=Cc8cc[nH]c8[CH+]7)cc[nH]2 10,11=10,20

Priority: 2920

CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH+:20]3)cc[nH]2.CC(C)[C@@H]1C=C2C(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH+]3)[CH:10]=[CH:11]N2>>CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH:20]3[CH:10]5[CH+:11]NC6=C[C@H]([C@@H](C=C56)[C@H]7C=Cc8cc[nH]c8[CH+]7)C(C)C)cc[nH]2
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH+:20]3)cc[nH]2.CC(C)[C@@H]1C=C2C(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH+]3)[CH:10]=[CH:11]N2>>CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH:20]3[CH:10]5[CH+:11]NC6=C[C@H]([C@@H](C=C56)[C@H]7C=Cc8cc[nH]c8[CH+]7)C(C)C)cc[nH]2 10,11=10,20

Priority: 2000

CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH+:20]3)cc[nH]2.CC(C)[C@@H]1C=C2[C:11](=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH+]3)[CH:10]=CN2>>CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH:20]3[CH:10]=CNC5=C[C@H]([C@@H](C=[C+:11]5)[C@H]6C=Cc7cc[nH]c7[CH+]6)C(C)C)cc[nH]2
( 2 sigma 1 2 5 p None 0 )
σ_C-C > p_C CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH+:20]3)cc[nH]2.CC(C)[C@@H]1C=C2[C:11](=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH+]3)[CH:10]=CN2>>CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4cc[nH]c4[CH:20]3[CH:10]=CNC5=C[C@H]([C@@H](C=[C+:11]5)[C@H]6C=Cc7cc[nH]c7[CH+]6)C(C)C)cc[nH]2 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=CC2=CC=C(C=C2[C@H]1[C@H]3[CH+]C=Cc4c3cc(cc4)C(F)(F)F)C(F)(F)F
Highest priority first:

Priority: 2985

CC(C)[C@H]1C=CC2=CC=C([CH:10]=[C:11]2[C@H]1[C@H]3[CH+:20]C=Cc4c3cc(cc4)C(F)(F)F)C(F)(F)F>>CC(C)[C@H]1C=CC2=CC=C([CH:10]3[C+:11]2[C@H]1[C@H]4[CH:20]3C=Cc5c4cc(cc5)C(F)(F)F)C(F)(F)F
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC2=CC=C([CH:10]=[C:11]2[C@H]1[C@H]3[CH+:20]C=Cc4c3cc(cc4)C(F)(F)F)C(F)(F)F>>CC(C)[C@H]1C=CC2=CC=C([CH:10]3[C+:11]2[C@H]1[C@H]4[CH:20]3C=Cc5c4cc(cc5)C(F)(F)F)C(F)(F)F 10,11=10,20

Priority: 2980

CC(C)[C@H]1C=C[C:11]2=[CH:10]C=C(C=C2[C@H]1[C@H]3[CH+:20]C=Cc4c3cc(cc4)C(F)(F)F)C(F)(F)F>>CC(C)[C@H]1C=C[C+:11]2[CH:10]3C=C(C=C2[C@H]1[C@H]4[CH:20]3C=Cc5c4cc(cc5)C(F)(F)F)C(F)(F)F
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=C[C:11]2=[CH:10]C=C(C=C2[C@H]1[C@H]3[CH+:20]C=Cc4c3cc(cc4)C(F)(F)F)C(F)(F)F>>CC(C)[C@H]1C=C[C+:11]2[CH:10]3C=C(C=C2[C@H]1[C@H]4[CH:20]3C=Cc5c4cc(cc5)C(F)(F)F)C(F)(F)F 10,11=10,20

Reagent: 5
Reactant Smiles: CC(O)(O)[OH+][C@H]([OH2+])[O-]
Highest priority first:

Priority: 6973

C[C:20](O)([OH:10])[OH+:21][C@H]([OH2+])[O-]>>C[C:20](=[OH+:10])O.[C@H]([OH2+])([OH:21])[O-]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-O C[C:20](O)([OH:10])[OH+:21][C@H]([OH2+])[O-]>>C[C:20](=[OH+:10])O.[C@H]([OH2+])([OH:21])[O-] 10=20;20,21=21

Priority: 4100

C[C:20](O)(O)[OH+:21][C@H]([OH2+])[O-]>>C[C+:20](O)O.[C@H]([OH2+])([OH:21])[O-]
( 1 sigma 2 2 1 sigma 2 2 )
σ_C-O > σ^*_C-O C[C:20](O)(O)[OH+:21][C@H]([OH2+])[O-]>>C[C+:20](O)O.[C@H]([OH2+])([OH:21])[O-] 20,21=21

Reagent: 3
Reactant Smiles: C[C@H]1C[C+]2C=CC=C[C@H]2[C@H]3[C@@H]1C=CC=C3CC=C
Highest priority first:

Priority: 7084

C[C@H]1C[C+:20]2C=CC=C[C@H]2[C@H]3[C@@H]1[CH:11]=[CH:10]C=C3CC=C>>C[C@H]1C[C:20]23C=CC=C[C@H]2[C@H]4[C@@H]1[CH+:11][CH:10]3C=C4CC=C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C C[C@H]1C[C+:20]2C=CC=C[C@H]2[C@H]3[C@@H]1[CH:11]=[CH:10]C=C3CC=C>>C[C@H]1C[C:20]23C=CC=C[C@H]2[C@H]4[C@@H]1[CH+:11][CH:10]3C=C4CC=C 10,11=10,20

Priority: 7082

C[C@H]1C[C+:20]2C=CC=C[C@H]2[C@H]3[C@@H]1C=C[CH:10]=[C:11]3CC=C>>C[C@H]1C[C:20]23C=CC=C[C@H]2[C@H]4[C@@H]1C=C[CH:10]3[C+:11]4CC=C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C C[C@H]1C[C+:20]2C=CC=C[C@H]2[C@H]3[C@@H]1C=C[CH:10]=[C:11]3CC=C>>C[C@H]1C[C:20]23C=CC=C[C@H]2[C@H]4[C@@H]1C=C[CH:10]3[C+:11]4CC=C 10,11=10,20

Priority: 7030

C[C@H]1C[C+:20]2[CH:10]=[CH:11]C=C[C@H]2[C@H]3[C@@H]1C=CC=C3CC=C>>C[C@H]1C[C:20]2=[CH:10][CH+:11]C=C[C@H]2[C@H]3[C@@H]1C=CC=C3CC=C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C C[C@H]1C[C+:20]2[CH:10]=[CH:11]C=C[C@H]2[C@H]3[C@@H]1C=CC=C3CC=C>>C[C@H]1C[C:20]2=[CH:10][CH+:11]C=C[C@H]2[C@H]3[C@@H]1C=CC=C3CC=C 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4c(cccc4C(=O)C)[CH+]3)cccc2C(=O)C.CC(=O)c1cccc2c1C=CC=C2
Highest priority first:

Priority: 2830

CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4c(cccc4C(=O)C)[CH+:20]3)cccc2C(=O)C.CC(=O)c1cccc2c1C=C[CH:11]=[CH:10]2>>CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4c(cccc4C(=O)C)[CH:20]3[CH:10]5[CH+:11]C=Cc6c5cccc6C(=O)C)cccc2C(=O)C
( 3 pi 2 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4c(cccc4C(=O)C)[CH+:20]3)cccc2C(=O)C.CC(=O)c1cccc2c1C=C[CH:11]=[CH:10]2>>CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4c(cccc4C(=O)C)[CH:20]3[CH:10]5[CH+:11]C=Cc6c5cccc6C(=O)C)cccc2C(=O)C 10,11=10,20

Priority: 2000

CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4c(cccc4C(=O)C)[CH+:20]3)cccc2C(=O)C.CC(=O)c1cccc2c1C=C[CH:10]=[CH:11]2>>CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4c(cccc4C(=O)C)[CH:20]3[CH:10]5C=Cc6c(cccc6C(=O)C)[CH+:11]5)cccc2C(=O)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4c(cccc4C(=O)C)[CH+:20]3)cccc2C(=O)C.CC(=O)c1cccc2c1C=C[CH:10]=[CH:11]2>>CC(C)[C@@H]1C=c2c(=C[C@H]1[C@H]3C=Cc4c(cccc4C(=O)C)[CH:20]3[CH:10]5C=Cc6c(cccc6C(=O)C)[CH+:11]5)cccc2C(=O)C 10,11=10,20

Reagent: 3
Reactant Smiles: CC[O@@H+][C@@](C=C)([O-])OC(=O)C
Highest priority first:

Priority: 6983

CC[O@@H+][C@@:20](C=C)([O-:10])[O:21]C(=O)C>>CC[O@@H+][C@@:20](=[O:10])C=C.CC(=O)[O-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CC[O@@H+][C@@:20](C=C)([O-:10])[O:21]C(=O)C>>CC[O@@H+][C@@:20](=[O:10])C=C.CC(=O)[O-:21] 10=20;20,21=21

Priority: 6970

CC[O@@H+:21][C@@:20](C=C)([O-])[O:10]C(=O)C>>CC[OH:21].CC(=O)[O+:10]=[C@:20](C=C)[O-]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-O CC[O@@H+:21][C@@:20](C=C)([O-])[O:10]C(=O)C>>CC[OH:21].CC(=O)[O+:10]=[C@:20](C=C)[O-] 10=20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=CC=C2[C@]1(C=C(C=C2)S(=O)(=O)O)[C@@H]3C=c4cc(ccc4=C[CH+]3)S(=O)(=O)O
Highest priority first:

Priority: 7084

CC(C)[C@@H]1[CH:11]=[CH:10]C=C2[C@]1(C=C(C=C2)S(=O)(=O)O)[C@@H]3C=c4cc(ccc4=C[CH+:20]3)S(=O)(=O)O>>CC(C)[C@@H]1[CH+:11][CH:10]2C=C3[C@]1(C=C(C=C3)S(=O)(=O)O)[C@H]4[CH:20]2C=c5ccc(cc5=C4)S(=O)(=O)O
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH:11]=[CH:10]C=C2[C@]1(C=C(C=C2)S(=O)(=O)O)[C@@H]3C=c4cc(ccc4=C[CH+:20]3)S(=O)(=O)O>>CC(C)[C@@H]1[CH+:11][CH:10]2C=C3[C@]1(C=C(C=C3)S(=O)(=O)O)[C@H]4[CH:20]2C=c5ccc(cc5=C4)S(=O)(=O)O 10,11=10,20

Priority: 7082

CC(C)[C@@H]1C=CC=C2[C@]1([CH:11]=[C:10](C=C2)S(=O)(=O)O)[C@@H]3C=c4cc(ccc4=C[CH+:20]3)S(=O)(=O)O>>CC(C)[C@@H]1C=CC=C2[C@@]13[CH+:11][C:10](C=C2)([CH:20]4[C@H]3C=c5cc(ccc5=C4)S(=O)(=O)O)S(=O)(=O)O
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=CC=C2[C@]1([CH:11]=[C:10](C=C2)S(=O)(=O)O)[C@@H]3C=c4cc(ccc4=C[CH+:20]3)S(=O)(=O)O>>CC(C)[C@@H]1C=CC=C2[C@@]13[CH+:11][C:10](C=C2)([CH:20]4[C@H]3C=c5cc(ccc5=C4)S(=O)(=O)O)S(=O)(=O)O 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=CC=C([C@@]1([C@@H]2C=CC=C([C+]2Br)OC)OC)Br
Highest priority first:

Priority: 7084

CC(C)[C@@H]1[CH:11]=[CH:10]C=C([C@@]1([C@@H]2C=CC=C([C+:20]2Br)OC)OC)Br>>CC(C)[C@@H]1[CH+:11][CH:10]2C=C([C@@]1([C@H]3[C:20]2(C(=CC=C3)OC)Br)OC)Br
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH:11]=[CH:10]C=C([C@@]1([C@@H]2C=CC=C([C+:20]2Br)OC)OC)Br>>CC(C)[C@@H]1[CH+:11][CH:10]2C=C([C@@]1([C@H]3[C:20]2(C(=CC=C3)OC)Br)OC)Br 10,11=10,20

Priority: 7082

CC(C)[C@@H]1C=C[CH:10]=[C:11]([C@@]1([C@@H]2C=CC=C([C+:20]2Br)OC)OC)Br>>CC(C)[C@@H]1C=C[CH:10]2[C+:11]([C@@]1([C@H]3[C:20]2(C(=CC=C3)OC)Br)OC)Br
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C[CH:10]=[C:11]([C@@]1([C@@H]2C=CC=C([C+:20]2Br)OC)OC)Br>>CC(C)[C@@H]1C=C[CH:10]2[C+:11]([C@@]1([C@H]3[C:20]2(C(=CC=C3)OC)Br)OC)Br 10,11=10,20

Reagent: 27
Reactant Smiles: C[C@]([OH2+])(O)O[C@@](C)(O)[O-]
Highest priority first:

Priority: 6975

C[C@]([OH2+])(O)O[C@@:20](C)([OH:21])[O-:10]>>C[C@:20](=[O:10])O[C@@](C)([OH2+])O.[OH-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O C[C@]([OH2+])(O)O[C@@:20](C)([OH:21])[O-:10]>>C[C@:20](=[O:10])O[C@@](C)([OH2+])O.[OH-:21] 10=20;20,21=21

Priority: 6973

C[C@:20]([OH2+:21])([OH:10])O[C@@](C)(O)[O-]>>C[C@:20](=[OH+:10])O[C@@](C)(O)[O-].[OH2:21]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-O C[C@:20]([OH2+:21])([OH:10])O[C@@](C)(O)[O-]>>C[C@:20](=[OH+:10])O[C@@](C)(O)[O-].[OH2:21] 10=20;20,21=21

Priority: 6970

C[C@:20]([OH2+:21])(O)[O:10][C@@](C)(O)[O-]>>C[C@@:20](=[O+:10][C@@](C)(O)[O-])O.[OH2:21]
( 2 sp3 None 2 1 sigma 8 2 )
n_O > σ^*_C-O C[C@:20]([OH2+:21])(O)[O:10][C@@](C)(O)[O-]>>C[C@@:20](=[O+:10][C@@](C)(O)[O-])O.[OH2:21] 10=20;20,21=21

Priority: 4100

C[C@:20]([OH2+:21])(O)O[C@@](C)(O)[O-]>>C[C@+:20](O)O[C@@](C)(O)[O-].[OH2:21]
( 1 sigma 2 2 1 sigma 2 2 )
σ_C-O > σ^*_C-O C[C@:20]([OH2+:21])(O)O[C@@](C)(O)[O-]>>C[C@+:20](O)O[C@@](C)(O)[O-].[OH2:21] 20,21=21

Reagent: 3
Reactant Smiles: C[C+]1C=CC=C[C@H]1[C@]2(C=CC=C[C@H]2C(C)C)C
Highest priority first:

Priority: 7084

C[C+:20]1C=CC=C[C@H]1[C@]2(C=C[CH:10]=[CH:11][C@H]2C(C)C)C>>CC(C)[C@@H]1[CH+:11][CH:10]2C=C[C@@]1([C@H]3[C:20]2(C=CC=C3)C)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C C[C+:20]1C=CC=C[C@H]1[C@]2(C=C[CH:10]=[CH:11][C@H]2C(C)C)C>>CC(C)[C@@H]1[CH+:11][CH:10]2C=C[C@@]1([C@H]3[C:20]2(C=CC=C3)C)C 10,11=10,20

Priority: 7082

C[C+:20]1C=CC=C[C@H]1[C@]2([CH:11]=[CH:10]C=C[C@H]2C(C)C)C>>CC(C)[C@@H]1C=C[CH:10]2[CH+:11][C@@]1([C@H]3[C:20]2(C=CC=C3)C)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C C[C+:20]1C=CC=C[C@H]1[C@]2([CH:11]=[CH:10]C=C[C@H]2C(C)C)C>>CC(C)[C@@H]1C=C[CH:10]2[CH+:11][C@@]1([C@H]3[C:20]2(C=CC=C3)C)C 10,11=10,20

Priority: 7030

C[C+:20]1[CH:10]=[CH:11]C=C[C@H]1[C@]2(C=CC=C[C@H]2C(C)C)C>>C[C:20]1=[CH:10][CH+:11]C=C[C@H]1[C@]2(C=CC=C[C@H]2C(C)C)C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C C[C+:20]1[CH:10]=[CH:11]C=C[C@H]1[C@]2(C=CC=C[C@H]2C(C)C)C>>C[C:20]1=[CH:10][CH+:11]C=C[C@H]1[C@]2(C=CC=C[C@H]2C(C)C)C 10,11=10,20

Reagent: 3
Reactant Smiles: CC(=CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+]2)C=C(C)C)C(C)(C)Cc3ccccc3)C.CC(=CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+]2)C=C(C)C)C(C)(C)CC3=CC=CC=C3)C
Highest priority first:

Priority: 2500

CC(=CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+:20]2)C=C(C)C)C(C)(C)Cc3ccccc3)C.CC(=CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+]2)C=C(C)C)C(C)(C)C[C:11]3=[CH:10]C=CC=C3)C>>CC(=CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+]2)C=C(C)C)C(C)(C)C[C+:11]3C=CC=C[CH:10]3[CH:20]4[C@@H](C=CC=C4C=C(C)C)[C@H]5C=CC(=C[C@@H]5C(C)(C)Cc6ccccc6)C=C(C)C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(=CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+:20]2)C=C(C)C)C(C)(C)Cc3ccccc3)C.CC(=CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+]2)C=C(C)C)C(C)(C)C[C:11]3=[CH:10]C=CC=C3)C>>CC(=CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+]2)C=C(C)C)C(C)(C)C[C+:11]3C=CC=C[CH:10]3[CH:20]4[C@@H](C=CC=C4C=C(C)C)[C@H]5C=CC(=C[C@@H]5C(C)(C)Cc6ccccc6)C=C(C)C)C 10,11=10,20

Priority: 2000

CC(=CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+:20]2)C=C(C)C)C(C)(C)Cc3ccccc3)C.CC(=CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+]2)C=C(C)C)C(C)(C)CC3=C[CH:10]=[CH:11]C=C3)C>>CC(=CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+]2)C=C(C)C)C(C)(C)CC3=C[CH:10]([CH+:11]C=C3)[CH:20]4[C@@H](C=CC=C4C=C(C)C)[C@H]5C=CC(=C[C@@H]5C(C)(C)Cc6ccccc6)C=C(C)C)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(=CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+:20]2)C=C(C)C)C(C)(C)Cc3ccccc3)C.CC(=CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+]2)C=C(C)C)C(C)(C)CC3=C[CH:10]=[CH:11]C=C3)C>>CC(=CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+]2)C=C(C)C)C(C)(C)CC3=C[CH:10]([CH+:11]C=C3)[CH:20]4[C@@H](C=CC=C4C=C(C)C)[C@H]5C=CC(=C[C@@H]5C(C)(C)Cc6ccccc6)C=C(C)C)C 10,11=10,20

Reagent: 140
Reactant Smiles: [1H][C@](/C(=C/c1ccccc1)/O)(C(=O)/C=C(/Cc2ccccc2)\O)C(=O)O.CC[O-]
Highest priority first:

Priority: 4424 $[H:20][C@:21](/C(=C/c1ccccc1)/O)(C(=O)/C=C(/Cc2ccccc2)\O)[C:22](=[O:23])O.CC[O-:10]>>[H:20][O:10]CC.c1ccc(cc1)C/C(=C/C(=O)[C@@:21](=[C:22](O)[O-:23])/C(=C/c2ccccc2)/O)/O$
[H:20][C@:21](/C(=C/c1ccccc1)/O)(C(=O)/C=C(/Cc2ccccc2)\O)[C:22](=[O:23])O.CC[O-:10]>>[H:20][O:10]CC.c1ccc(cc1)C/C(=C/C(=O)[C@@:21](=[C:22](O)[O-:23])/C(=C/c2ccccc2)/O)/O
( 5 sp3 None 2 4 sigma 3 2; 1 pi 2 2 )
n_O > σ^*_H-C > π^*_C=O [H:20][C@:21](/C(=C/c1ccccc1)/O)(C(=O)/C=C(/Cc2ccccc2)\O)[C:22](=[O:23])O.CC[O-:10]>>[H:20][O:10]CC.c1ccc(cc1)C/C(=C/C(=O)[C@@:21](=[C:22](O)[O-:23])/C(=C/c2ccccc2)/O)/O 10=20;20,21=21,22;22,23=23

Priority: 4420 $[H:20][C@:21](/C(=C/c1ccccc1)/O)(C(=O)/C=C(/Cc2ccccc2)\O)C(=O)O.CC[O-:10]>>[H:20][O:10]CC.c1ccc(cc1)C/C(=C/C(=O)[C@-:21](/C(=C/c2ccccc2)/O)C(=O)O)/O$
[H:20][C@:21](/C(=C/c1ccccc1)/O)(C(=O)/C=C(/Cc2ccccc2)\O)C(=O)O.CC[O-:10]>>[H:20][O:10]CC.c1ccc(cc1)C/C(=C/C(=O)[C@-:21](/C(=C/c2ccccc2)/O)C(=O)O)/O
( 5 sp3 None 2 4 sigma 3 2 )
n_O > σ^*_H-C [H:20][C@:21](/C(=C/c1ccccc1)/O)(C(=O)/C=C(/Cc2ccccc2)\O)C(=O)O.CC[O-:10]>>[H:20][O:10]CC.c1ccc(cc1)C/C(=C/C(=O)[C@-:21](/C(=C/c2ccccc2)/O)C(=O)O)/O 10=20;20,21=21

Reagent: 3
Reactant Smiles: CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=C(C=C[CH+]2)C#C)C#C
Highest priority first:

Priority: 7084

CC(C)[C@@H]1[CH:11]=[C:10](C=C[C@H]1[C@@H]2C=C(C=C[CH+:20]2)C#C)C#C>>CC(C)[C@@H]1[CH+:11][C:10]2(C=C[C@H]1[C@H]3[CH:20]2C=CC(=C3)C#C)C#C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH:11]=[C:10](C=C[C@H]1[C@@H]2C=C(C=C[CH+:20]2)C#C)C#C>>CC(C)[C@@H]1[CH+:11][C:10]2(C=C[C@H]1[C@H]3[CH:20]2C=CC(=C3)C#C)C#C 10,11=10,20

Priority: 7082

CC(C)[C@@H]1C=C([CH:10]=[CH:11][C@H]1[C@@H]2C=C(C=C[CH+:20]2)C#C)C#C>>CC(C)[C@@H]1C=C([CH:10]2[CH+:11][C@H]1[C@H]3[CH:20]2C=CC(=C3)C#C)C#C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C([CH:10]=[CH:11][C@H]1[C@@H]2C=C(C=C[CH+:20]2)C#C)C#C>>CC(C)[C@@H]1C=C([CH:10]2[CH+:11][C@H]1[C@H]3[CH:20]2C=CC(=C3)C#C)C#C 10,11=10,20

Priority: 7030

CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=C([CH:11]=[CH:10][CH+:20]2)C#C)C#C>>CC(C)[C@@H]1C=C(C=C[C@H]1[C@H]2[CH:20]=[CH:10][CH+:11]C(=C2)C#C)C#C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C(C=C[C@H]1[C@@H]2C=C([CH:11]=[CH:10][CH+:20]2)C#C)C#C>>CC(C)[C@@H]1C=C(C=C[C@H]1[C@H]2[CH:20]=[CH:10][CH+:11]C(=C2)C#C)C#C 10,11=10,20

Reagent: 3
Reactant Smiles: C/C=C/C1=C[CH+][C@@H](C=C1)[C@@]2(C=CC=C[C@@H]2[C@@H](C)Cc3ccccc3)/C=C/C
Highest priority first:

Priority: 7084

C/C=C/C1=C[CH+:20][C@@H](C=C1)[C@@]2(C=C[CH:10]=[CH:11][C@@H]2[C@@H](C)Cc3ccccc3)/C=C/C>>C/C=C/C1=C[CH:20]2[CH:10]3C=C[C@@]([C@@H]2C=C1)([C@H]([CH+:11]3)[C@@H](C)Cc4ccccc4)/C=C/C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C C/C=C/C1=C[CH+:20][C@@H](C=C1)[C@@]2(C=C[CH:10]=[CH:11][C@@H]2[C@@H](C)Cc3ccccc3)/C=C/C>>C/C=C/C1=C[CH:20]2[CH:10]3C=C[C@@]([C@@H]2C=C1)([C@H]([CH+:11]3)[C@@H](C)Cc4ccccc4)/C=C/C 10,11=10,20

Priority: 7082

C/C=C/C1=C[CH+:20][C@@H](C=C1)[C@@]2(C=CC=C[C@@H]2[C@@H](C)Cc3ccccc3)/[CH:11]=[CH:10]/C>>C/C=C/C1=C[CH:20]2[CH:10]([CH+:11][C@@]3([C@@H]2C=C1)C=CC=C[C@@H]3[C@@H](C)Cc4ccccc4)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C C/C=C/C1=C[CH+:20][C@@H](C=C1)[C@@]2(C=CC=C[C@@H]2[C@@H](C)Cc3ccccc3)/[CH:11]=[CH:10]/C>>C/C=C/C1=C[CH:20]2[CH:10]([CH+:11][C@@]3([C@@H]2C=C1)C=CC=C[C@@H]3[C@@H](C)Cc4ccccc4)C 10,11=10,20

Priority: 7030

C/C=C/[C:11]1=[CH:10][CH+:20][C@@H](C=C1)[C@@]2(C=CC=C[C@@H]2[C@@H](C)Cc3ccccc3)/C=C/C>>C/C=C/[C+:11]1[CH:10]=[CH:20][C@@H](C=C1)[C@@]2(C=CC=C[C@@H]2[C@@H](C)Cc3ccccc3)/C=C/C
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C C/C=C/[C:11]1=[CH:10][CH+:20][C@@H](C=C1)[C@@]2(C=CC=C[C@@H]2[C@@H](C)Cc3ccccc3)/C=C/C>>C/C=C/[C+:11]1[CH:10]=[CH:20][C@@H](C=C1)[C@@]2(C=CC=C[C@@H]2[C@@H](C)Cc3ccccc3)/C=C/C 10,11=10,20

Reagent: 8
Reactant Smiles: CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Priority: 2955

CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C:13]4=[CH:12][CH:11]=[CH:10]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C+:13]4[CH:12]=[CH:11][CH:10](C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C:11]4=[CH:10]C=CC=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/[C+:11]4C=CC=C[CH:10]4[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=CC=C[CH:10]=[CH:11]4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=CC=C[CH:10]([CH+:11]4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=C[CH:10]=[CH:11]C=C4.c1ccc(cc1)[N+:21]#[N:20].[Cl-]>>CC1=C[C@H]([C+](C=C1)N(C)C)/N=N/[C+]2C=CC(C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=C[CH:10]([CH+:11]C=C4)[N:20]=[N:21]c5ccccc5.[Cl-] 10,11=10,20;20,21=21

Reagent: 25
Reactant Smiles: CC1=C[CH]C2=C[CH+][C@@H](C=C2[CH]1)[N+](=O)[O-].[N+](=O)=O
Highest priority first:

Priority: 2500

C[C:11]1=[CH:10][CH]C2=C[CH+][C@@H](C=C2[CH]1)[N+](=O)[O-].[N+:20](=O)=[O:21]>>C[C+:11]1[CH]C2=C[C@H]([CH+]C=C2[CH][CH:10]1[N+:20](=O)[O-:21])[N+](=O)[O-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N=O C[C:11]1=[CH:10][CH]C2=C[CH+][C@@H](C=C2[CH]1)[N+](=O)[O-].[N+:20](=O)=[O:21]>>C[C+:11]1[CH]C2=C[C@H]([CH+]C=C2[CH][CH:10]1[N+:20](=O)[O-:21])[N+](=O)[O-] 10,11=10,20;20,21=21

Priority: 2000

CC1=C[CH:10][C:11]2=C[CH+][C@@H](C=C2[CH]1)[N+](=O)[O-].[N+:20](=O)=[O:21]>>CC(=C[CH:10][N+:20](=O)[O-:21])[CH]C1=C[C@H]([CH+]C=[C+:11]1)[N+](=O)[O-]
( 2 sigma 1 2 5 pi 6 2 )
σ_C-C > π^*_N=O CC1=C[CH:10][C:11]2=C[CH+][C@@H](C=C2[CH]1)[N+](=O)[O-].[N+:20](=O)=[O:21]>>CC(=C[CH:10][N+:20](=O)[O-:21])[CH]C1=C[C@H]([CH+]C=[C+:11]1)[N+](=O)[O-] 10,11=10,20;20,21=21

Reagent: 25
Reactant Smiles: COC1=CC=C2[CH+][C@@H](C=CC2=C1)[N+](=O)[O-].[N+](=O)=O
Highest priority first:

Priority: 2950

CO[C:11]1=[CH:10]C=C2[CH+][C@@H](C=CC2=C1)[N+](=O)[O-].[N+:20](=O)=[O:21]>>CO[C+:11]1C=C2C=C[C@H]([CH+]C2=C[CH:10]1[N+:20](=O)[O-:21])[N+](=O)[O-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N=O CO[C:11]1=[CH:10]C=C2[CH+][C@@H](C=CC2=C1)[N+](=O)[O-].[N+:20](=O)=[O:21]>>CO[C+:11]1C=C2C=C[C@H]([CH+]C2=C[CH:10]1[N+:20](=O)[O-:21])[N+](=O)[O-] 10,11=10,20;20,21=21

Priority: 2500

COC1=C[CH:10]=[C:11]2[CH+][C@@H](C=CC2=C1)[N+](=O)[O-].[N+:20](=O)=[O:21]>>COC1=C[CH:10]([C+:11]2[CH+][C@@H](C=CC2=C1)[N+](=O)[O-])[N+:20](=O)[O-:21]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N=O COC1=C[CH:10]=[C:11]2[CH+][C@@H](C=CC2=C1)[N+](=O)[O-].[N+:20](=O)=[O:21]>>COC1=C[CH:10]([C+:11]2[CH+][C@@H](C=CC2=C1)[N+](=O)[O-])[N+:20](=O)[O-:21] 10,11=10,20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=C(C=C2[C@]1(C=CC=C2)[C@@H]3C=C(C=C4[C+]3C=CC=C4)Br)Br
Highest priority first:

Priority: 7084

CC(C)[C@@H]1[CH:11]=[C:10](C=C2[C@]1(C=CC=C2)[C@@H]3C=C(C=C4[C+:20]3C=CC=C4)Br)Br>>CC(C)[C@@H]1[CH+:11][C:10]2(C=C3[C@]1(C=CC=C3)[C@H]4[C:20]25C=CC=CC5=CC(=C4)Br)Br
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH:11]=[C:10](C=C2[C@]1(C=CC=C2)[C@@H]3C=C(C=C4[C+:20]3C=CC=C4)Br)Br>>CC(C)[C@@H]1[CH+:11][C:10]2(C=C3[C@]1(C=CC=C3)[C@H]4[C:20]25C=CC=CC5=CC(=C4)Br)Br 10,11=10,20

Priority: 7082

CC(C)[C@@H]1C=C(C=C2[C@]1([CH:11]=[CH:10]C=C2)[C@@H]3C=C(C=C4[C+:20]3C=CC=C4)Br)Br>>CC(C)[C@@H]1C=C(C=C2[C@@]13[CH+:11][CH:10](C=C2)[C:20]45[C@H]3C=C(C=C4C=CC=C5)Br)Br
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C(C=C2[C@]1([CH:11]=[CH:10]C=C2)[C@@H]3C=C(C=C4[C+:20]3C=CC=C4)Br)Br>>CC(C)[C@@H]1C=C(C=C2[C@@]13[CH+:11][CH:10](C=C2)[C:20]45[C@H]3C=C(C=C4C=CC=C5)Br)Br 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=CC(=C([C@H]1[C@@H]2C=CC(=C([CH+]2)OC)Br)OC)Br
Highest priority first:

Priority: 7084

CC(C)[C@@H]1[CH:11]=[CH:10]C(=C([C@H]1[C@@H]2C=CC(=C([CH+:20]2)OC)Br)OC)Br>>CC(C)[C@@H]1[CH+:11][CH:10]2[CH:20]3[C@H]([C@@H]1C(=C2Br)OC)C=CC(=C3OC)Br
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH:11]=[CH:10]C(=C([C@H]1[C@@H]2C=CC(=C([CH+:20]2)OC)Br)OC)Br>>CC(C)[C@@H]1[CH+:11][CH:10]2[CH:20]3[C@H]([C@@H]1C(=C2Br)OC)C=CC(=C3OC)Br 10,11=10,20

Priority: 7082

CC(C)[C@@H]1C=C[C:10](=[C:11]([C@H]1[C@@H]2C=CC(=C([CH+:20]2)OC)Br)OC)Br>>CC(C)[C@@H]1C=C[C:10]2([CH:20]3[C@H]([C@@H]1[C+:11]2OC)C=CC(=C3OC)Br)Br
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=C[C:10](=[C:11]([C@H]1[C@@H]2C=CC(=C([CH+:20]2)OC)Br)OC)Br>>CC(C)[C@@H]1C=C[C:10]2([CH:20]3[C@H]([C@@H]1[C+:11]2OC)C=CC(=C3OC)Br)Br 10,11=10,20

Reagent: 3
Reactant Smiles: COC[C@H](c1ccccc1)[C@@H]2C=C(C=C[C@H]2[C@H]3C=CC=C([CH+]3)/C=C/OC)/C=C/OC
Highest priority first:

Priority: 7084

COC[C@H](c1ccccc1)[C@@H]2[CH:11]=[C:10](C=C[C@H]2[C@H]3C=CC=C([CH+:20]3)/C=C/OC)/C=C/OC>>COC[C@H](c1ccccc1)[C@@H]2[CH+:11][C:10]3(C=C[C@H]2[C@@H]4[CH:20]3C(=CC=C4)/C=C/OC)/C=C/OC
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C COC[C@H](c1ccccc1)[C@@H]2[CH:11]=[C:10](C=C[C@H]2[C@H]3C=CC=C([CH+:20]3)/C=C/OC)/C=C/OC>>COC[C@H](c1ccccc1)[C@@H]2[CH+:11][C:10]3(C=C[C@H]2[C@@H]4[CH:20]3C(=CC=C4)/C=C/OC)/C=C/OC 10,11=10,20

Priority: 7082

COC[C@H](c1ccccc1)[C@@H]2C=C([CH:10]=[CH:11][C@H]2[C@H]3C=CC=C([CH+:20]3)/C=C/OC)/C=C/OC>>COC[C@H](c1ccccc1)[C@@H]2C=C([CH:10]3[CH+:11][C@H]2[C@@H]4[CH:20]3C(=CC=C4)/C=C/OC)/C=C/OC
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C COC[C@H](c1ccccc1)[C@@H]2C=C([CH:10]=[CH:11][C@H]2[C@H]3C=CC=C([CH+:20]3)/C=C/OC)/C=C/OC>>COC[C@H](c1ccccc1)[C@@H]2C=C([CH:10]3[CH+:11][C@H]2[C@@H]4[CH:20]3C(=CC=C4)/C=C/OC)/C=C/OC 10,11=10,20

Priority: 7030

COC[C@H](c1ccccc1)[C@@H]2C=C(C=C[C@H]2[C@H]3C=C[CH:11]=[C:10]([CH+:20]3)/C=C/OC)/C=C/OC>>COC[C@H](c1ccccc1)[C@@H]2C=C(C=C[C@H]2[C@H]3C=C[CH+:11][C:10](=[CH:20]3)/C=C/OC)/C=C/OC
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C COC[C@H](c1ccccc1)[C@@H]2C=C(C=C[C@H]2[C@H]3C=C[CH:11]=[C:10]([CH+:20]3)/C=C/OC)/C=C/OC>>COC[C@H](c1ccccc1)[C@@H]2C=C(C=C[C@H]2[C@H]3C=C[CH+:11][C:10](=[CH:20]3)/C=C/OC)/C=C/OC 10,11=10,20

Reagent: 66
Reactant Smiles: Cc1cccc2c1C=C[C@@H]([CH+]2)[C@]34C=CC=CC3=C(C=C[C@H]4C(C)C)C
Highest priority first:

Priority: 7084

Cc1cccc2c1C=C[C@@H]([CH+:20]2)[C@]34C=CC=CC3=C([CH:10]=[CH:11][C@H]4C(C)C)C>>Cc1cccc2c1C=C[C@H]3[CH:20]2[CH:10]4[CH+:11][C@H]([C@]35C=CC=CC5=C4C)C(C)C
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C Cc1cccc2c1C=C[C@@H]([CH+:20]2)[C@]34C=CC=CC3=C([CH:10]=[CH:11][C@H]4C(C)C)C>>Cc1cccc2c1C=C[C@H]3[CH:20]2[CH:10]4[CH+:11][C@H]([C@]35C=CC=CC5=C4C)C(C)C 10,11=10,20

Priority: 7082

Cc1cccc2c1C=C[C@@H]([CH+:20]2)[C@]34[CH:11]=[CH:10]C=CC3=C(C=C[C@H]4C(C)C)C>>Cc1cccc2c1C=C[C@H]3[CH:20]2[CH:10]4C=CC5=C(C=C[C@H]([C@]35[CH+:11]4)C(C)C)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C Cc1cccc2c1C=C[C@@H]([CH+:20]2)[C@]34[CH:11]=[CH:10]C=CC3=C(C=C[C@H]4C(C)C)C>>Cc1cccc2c1C=C[C@H]3[CH:20]2[CH:10]4C=CC5=C(C=C[C@H]([C@]35[CH+:11]4)C(C)C)C 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1[C@@H](NC2=CC=CC=C12)[C@H]3C=CC=C4[C+]3C=CN4
Highest priority first:

Priority: 2990

CC(C)[C@@H]1[C@@H](N[C:11]2=[CH:10]C=CC=C12)[C@H]3C=CC=C4[C+:20]3C=CN4>>CC(C)[C@@H]1[C@@H]2[C@H]3C=CC=C4[C:20]3(C=CN4)[CH:10]5C=CC=C1[C+:11]5N2
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[C@@H](N[C:11]2=[CH:10]C=CC=C12)[C@H]3C=CC=C4[C+:20]3C=CN4>>CC(C)[C@@H]1[C@@H]2[C@H]3C=CC=C4[C:20]3(C=CN4)[CH:10]5C=CC=C1[C+:11]5N2 10,11=10,20

Priority: 2985

CC(C)[C@@H]1[C@@H](NC2=CC=C[CH:10]=[C:11]12)[C@H]3C=CC=C4[C+:20]3C=CN4>>CC(C)[C@@H]1[C@@H]2[C@H]3C=CC=C4[C:20]3(C=CN4)[CH:10]5[C+:11]1C(=CC=C5)N2
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[C@@H](NC2=CC=C[CH:10]=[C:11]12)[C@H]3C=CC=C4[C+:20]3C=CN4>>CC(C)[C@@H]1[C@@H]2[C@H]3C=CC=C4[C:20]3(C=CN4)[CH:10]5[C+:11]1C(=CC=C5)N2 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2ccccc2=C[C@@]1(C#N)[C@@H]3C=CC=C4[C+]3C=CC(=C4)C#N.c1ccc2c(c1)C=CC(=C2)C#N
Highest priority first:

Priority: 2731

CC(C)[C@@H]1C=c2ccccc2=C[C@@]1(C#N)[C@@H]3C=CC=C4[C+:20]3C=CC(=C4)C#N.c1ccc2c(c1)[CH:10]=[CH:11]C(=C2)C#N>>CC(C)[C@@H]1C=c2ccccc2=C[C@@]1(C#N)[C@@H]3C=CC=C4[C:20]3(C=CC(=C4)C#N)[CH:10]5[CH+:11]C(=Cc6c5cccc6)C#N
( 3 pi 2 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2ccccc2=C[C@@]1(C#N)[C@@H]3C=CC=C4[C+:20]3C=CC(=C4)C#N.c1ccc2c(c1)[CH:10]=[CH:11]C(=C2)C#N>>CC(C)[C@@H]1C=c2ccccc2=C[C@@]1(C#N)[C@@H]3C=CC=C4[C:20]3(C=CC(=C4)C#N)[CH:10]5[CH+:11]C(=Cc6c5cccc6)C#N 10,11=10,20

Priority: 2540

CC(C)[C@@H]1C=c2ccccc2=C[C@@]1(C#N)[C@@H]3C=CC=C4[C+:20]3C=CC(=C4)C#N.c1ccc2c(c1)C=C[C:11](=[CH:10]2)C#N>>CC(C)[C@@H]1C=c2ccccc2=C[C@@]1(C#N)[C@@H]3C=CC=C4[C:20]3(C=CC(=C4)C#N)[CH:10]5c6ccccc6C=C[C+:11]5C#N
( 3 pi 2 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2ccccc2=C[C@@]1(C#N)[C@@H]3C=CC=C4[C+:20]3C=CC(=C4)C#N.c1ccc2c(c1)C=C[C:11](=[CH:10]2)C#N>>CC(C)[C@@H]1C=c2ccccc2=C[C@@]1(C#N)[C@@H]3C=CC=C4[C:20]3(C=CC(=C4)C#N)[CH:10]5c6ccccc6C=C[C+:11]5C#N 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@@H]3C=C(c4ccccc4[CH+]3)Br)Br.C1=CC2=CC=CC(=C2C=C1)Br
Highest priority first:

Priority: 2650

CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@@H]3C=C(c4ccccc4[CH+:20]3)Br)Br.C1=C[C:11]2=[CH:10]C=C[C:13](=[C:12]2C=C1)Br>>CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@@H]3C=C(c4ccccc4[CH:20]3[CH:10]5C=C[C+:13]([C:12]6=[C:11]5C=CC=C6)Br)Br)Br
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@@H]3C=C(c4ccccc4[CH+:20]3)Br)Br.C1=C[C:11]2=[CH:10]C=C[C:13](=[C:12]2C=C1)Br>>CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@@H]3C=C(c4ccccc4[CH:20]3[CH:10]5C=C[C+:13]([C:12]6=[C:11]5C=CC=C6)Br)Br)Br 10,11=10,20;12,13=11,12

Priority: 2600

CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@@H]3C=C(c4ccccc4[CH+:20]3)Br)Br.C1=CC2=CC=C[C:13](=[C:12]2[CH:11]=[CH:10]1)Br>>CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@@H]3C=C(c4ccccc4[CH:20]3[CH:10]5C=CC6=CC=C[C+:13]([C:12]6=[CH:11]5)Br)Br)Br
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@@H]3C=C(c4ccccc4[CH+:20]3)Br)Br.C1=CC2=CC=C[C:13](=[C:12]2[CH:11]=[CH:10]1)Br>>CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@@H]3C=C(c4ccccc4[CH:20]3[CH:10]5C=CC6=CC=C[C+:13]([C:12]6=[CH:11]5)Br)Br)Br 10,11=10,20;12,13=11,12

Priority: 2005

CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@@H]3C=C(c4ccccc4[CH+:20]3)Br)Br.C1=C[C:11]2=[CH:10]C=CC(=C2C=C1)Br>>CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@@H]3C=C(c4ccccc4[CH:20]3[CH:10]5C=CC(=C6[C+:11]5C=CC=C6)Br)Br)Br
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@@H]3C=C(c4ccccc4[CH+:20]3)Br)Br.C1=C[C:11]2=[CH:10]C=CC(=C2C=C1)Br>>CC(C)[C@@H]1C=c2cccc(c2=C[C@H]1[C@@H]3C=C(c4ccccc4[CH:20]3[CH:10]5C=CC(=C6[C+:11]5C=CC=C6)Br)Br)Br 10,11=10,20

Reagent: 3
Reactant Smiles: CC(C)[C@H]1C=CC(=C[C@H]1[C@@H]2C=CC=C([CH+]2)O)O
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[CH:10]C(=C[C@H]1[C@@H]2C=CC=C([CH+:20]2)O)O>>CC(C)[C@H]1[CH+:11][CH:10]2[CH:20]3[C@H]([C@@H]1C=C2O)C=CC=C3O
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[CH:10]C(=C[C@H]1[C@@H]2C=CC=C([CH+:20]2)O)O>>CC(C)[C@H]1[CH+:11][CH:10]2[CH:20]3[C@H]([C@@H]1C=C2O)C=CC=C3O 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=C[C:10](=[CH:11][C@H]1[C@@H]2C=CC=C([CH+:20]2)O)O>>CC(C)[C@H]1C=C[C:10]2([CH+:11][C@H]1[C@H]3[CH:20]2C(=CC=C3)O)O
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=C[C:10](=[CH:11][C@H]1[C@@H]2C=CC=C([CH+:20]2)O)O>>CC(C)[C@H]1C=C[C:10]2([CH+:11][C@H]1[C@H]3[CH:20]2C(=CC=C3)O)O 10,11=10,20

Priority: 7030

CC(C)[C@H]1C=CC(=C[C@H]1[C@@H]2C=C[CH:11]=[C:10]([CH+:20]2)O)O>>CC(C)[C@H]1C=CC(=C[C@H]1[C@@H]2C=C[CH+:11][C:10](=[CH:20]2)O)O
( 2 pi 3 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC(=C[C@H]1[C@@H]2C=C[CH:11]=[C:10]([CH+:20]2)O)O>>CC(C)[C@H]1C=CC(=C[C@H]1[C@@H]2C=C[CH+:11][C:10](=[CH:20]2)O)O 10,11=10,20

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@H]2C=C(C=C[CH+]2)/N=N/C3C=C[C+](C=C3)/N=N/[C@@H]4C=CC(=C[CH+]4)N.[Cl-]
Highest priority first:

Priority: 2955

c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@H]2C=C(C=C[CH+]2)/N=N/C3C=C[C+](C=C3)/N=N/[C@@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@H]3C=C(C=C[CH+]3)/N=N/C4C=C[C+](C=C4)/N=N/[C@@H]5C=CC(=C[CH+]5)N.[Cl-]
( 4 pi 3 2; 2 pi 1 2 5 pi 6 2 )
π_C=C > π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].[CH:10]1=[CH:11][CH:12]=[C:13](C=C1)/N=N/[C@H]2C=C(C=C[CH+]2)/N=N/C3C=C[C+](C=C3)/N=N/[C@@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2[CH:11]=[CH:12][C+:13](C=C2)/N=N/[C@H]3C=C(C=C[CH+]3)/N=N/C4C=C[C+](C=C4)/N=N/[C@@H]5C=CC(=C[CH+]5)N.[Cl-] 10,11=10,20;12,13=11,12;20,21=21

Priority: 2950

c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@H]2C=C(C=C[CH+]2)/N=N/C3C=C[C+](C=C3)/N=N/[C@@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@H]3C=C(C=C[CH+]3)/N=N/C4C=C[C+](C=C4)/N=N/[C@@H]5C=CC(=C[CH+]5)N.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=C[CH:10]=[C:11](C=C1)/N=N/[C@H]2C=C(C=C[CH+]2)/N=N/C3C=C[C+](C=C3)/N=N/[C@@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C[C+:11]2/N=N/[C@H]3C=C(C=C[CH+]3)/N=N/C4C=C[C+](C=C4)/N=N/[C@@H]5C=CC(=C[CH+]5)N.[Cl-] 10,11=10,20;20,21=21

Priority: 2740

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@H]2C=C(C=C[CH+]2)/N=N/C3C=C[C+](C=C3)/N=N/[C@@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@H]3C=C(C=C[CH+]3)/N=N/C4C=C[C+](C=C4)/N=N/[C@@H]5C=CC(=C[CH+]5)N.[Cl-]
( 3 pi 2 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@H]2C=C(C=C[CH+]2)/N=N/C3C=C[C+](C=C3)/N=N/[C@@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@H]3C=C(C=C[CH+]3)/N=N/C4C=C[C+](C=C4)/N=N/[C@@H]5C=CC(=C[CH+]5)N.[Cl-] 10,11=10,20;20,21=21

Priority: 2000

c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@H]2C=C(C=C[CH+]2)/N=N/C3C=C[C+](C=C3)/N=N/[C@@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@H]3C=C(C=C[CH+]3)/N=N/C4C=C[C+](C=C4)/N=N/[C@@H]5C=CC(=C[CH+]5)N.[Cl-]
( 2 pi 1 2 5 pi 6 2 )
π_C=C > π^*_N#N c1ccc(cc1)[N+:21]#[N:20].C1=CC=C([CH:11]=[CH:10]1)/N=N/[C@H]2C=C(C=C[CH+]2)/N=N/C3C=C[C+](C=C3)/N=N/[C@@H]4C=CC(=C[CH+]4)N.[Cl-]>>c1ccc(cc1)[N:21]=[N:20][CH:10]2C=CC=C([CH+:11]2)/N=N/[C@H]3C=C(C=C[CH+]3)/N=N/C4C=C[C+](C=C4)/N=N/[C@@H]5C=CC(=C[CH+]5)N.[Cl-] 10,11=10,20;20,21=21

Reagent: 66
Reactant Smiles: CC(C)[C@H]1[C@@H]2C=C[C+]3[C@@H]2C(=CC=C13)C(=O)C.CC(=O)c1ccc2c(c1)C=CC=C2
Highest priority first:

Priority: 2825

CC(C)[C@H]1[C@@H]2C=C[C+:20]3[C@@H]2C(=CC=C13)C(=O)C.CC(=O)c1ccc2c(c1)[CH:10]=[CH:11]C=C2>>CC(C)[C@H]1[C@@H]2C=C[C:20]3([C@@H]2C(=CC=C13)C(=O)C)[CH:10]4[CH+:11]C=Cc5c4cc(cc5)C(=O)C
( 3 pi 2 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1[C@@H]2C=C[C+:20]3[C@@H]2C(=CC=C13)C(=O)C.CC(=O)c1ccc2c(c1)[CH:10]=[CH:11]C=C2>>CC(C)[C@H]1[C@@H]2C=C[C:20]3([C@@H]2C(=CC=C13)C(=O)C)[CH:10]4[CH+:11]C=Cc5c4cc(cc5)C(=O)C 10,11=10,20

Priority: 2000

CC(C)[C@H]1[C@@H]2C=C[C+:20]3[C@@H]2C(=CC=C13)C(=O)C.CC(=O)c1ccc2c(c1)[CH:11]=[CH:10]C=C2>>CC(C)[C@H]1[C@@H]2C=C[C:20]3([C@@H]2C(=CC=C13)C(=O)C)[CH:10]4C=Cc5ccc(cc5[CH+:11]4)C(=O)C
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(C)[C@H]1[C@@H]2C=C[C+:20]3[C@@H]2C(=CC=C13)C(=O)C.CC(=O)c1ccc2c(c1)[CH:11]=[CH:10]C=C2>>CC(C)[C@H]1[C@@H]2C=C[C:20]3([C@@H]2C(=CC=C13)C(=O)C)[CH:10]4C=Cc5ccc(cc5[CH+:11]4)C(=O)C 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=CC(=C2[C@@]1(C=CC=C2)[C@@H]3C=CC=C4[C+]3C(=CC=C4)C#N)C#N
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[CH:10]C(=C2[C@@]1(C=CC=C2)[C@@H]3C=CC=C4[C+:20]3C(=CC=C4)C#N)C#N>>CC(C)[C@H]1[CH+:11][CH:10]2C(=C3[C@@]1(C=CC=C3)[C@H]4[C:20]25C(=CC=C4)C=CC=C5C#N)C#N
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[CH:10]C(=C2[C@@]1(C=CC=C2)[C@@H]3C=CC=C4[C+:20]3C(=CC=C4)C#N)C#N>>CC(C)[C@H]1[CH+:11][CH:10]2C(=C3[C@@]1(C=CC=C3)[C@H]4[C:20]25C(=CC=C4)C=CC=C5C#N)C#N 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=CC(=C2[C@@]1([CH:11]=[CH:10]C=C2)[C@@H]3C=CC=C4[C+:20]3C(=CC=C4)C#N)C#N>>CC(C)[C@H]1C=CC(=C2[C@]13[CH+:11][CH:10](C=C2)[C:20]45[C@H]3C=CC=C4C=CC=C5C#N)C#N
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC(=C2[C@@]1([CH:11]=[CH:10]C=C2)[C@@H]3C=CC=C4[C+:20]3C(=CC=C4)C#N)C#N>>CC(C)[C@H]1C=CC(=C2[C@]13[CH+:11][CH:10](C=C2)[C:20]45[C@H]3C=CC=C4C=CC=C5C#N)C#N 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=CC=C2[C@@]1(C=CC=C2C(F)(F)F)[C@@H]3C=c4ccccc4=C([CH+]3)C(F)(F)F
Highest priority first:

Priority: 7084

CC(C)[C@H]1[CH:11]=[CH:10]C=C2[C@@]1(C=CC=C2C(F)(F)F)[C@@H]3C=c4ccccc4=C([CH+:20]3)C(F)(F)F>>CC(C)[C@H]1[CH+:11][CH:10]2C=C3[C@@]1(C=CC=C3C(F)(F)F)[C@H]4[CH:20]2C(=c5ccccc5=C4)C(F)(F)F
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1[CH:11]=[CH:10]C=C2[C@@]1(C=CC=C2C(F)(F)F)[C@@H]3C=c4ccccc4=C([CH+:20]3)C(F)(F)F>>CC(C)[C@H]1[CH+:11][CH:10]2C=C3[C@@]1(C=CC=C3C(F)(F)F)[C@H]4[CH:20]2C(=c5ccccc5=C4)C(F)(F)F 10,11=10,20

Priority: 7082

CC(C)[C@H]1C=CC=C2[C@@]1([CH:11]=[CH:10]C=C2C(F)(F)F)[C@@H]3C=c4ccccc4=C([CH+:20]3)C(F)(F)F>>CC(C)[C@H]1C=CC=C2[C@]13[CH+:11][CH:10](C=C2C(F)(F)F)[CH:20]4[C@H]3C=c5ccccc5=C4C(F)(F)F
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@H]1C=CC=C2[C@@]1([CH:11]=[CH:10]C=C2C(F)(F)F)[C@@H]3C=c4ccccc4=C([CH+:20]3)C(F)(F)F>>CC(C)[C@H]1C=CC=C2[C@]13[CH+:11][CH:10](C=C2C(F)(F)F)[CH:20]4[C@H]3C=c5ccccc5=C4C(F)(F)F 10,11=10,20

Reagent: 28
Reactant Smiles: CC(=O)[C@@H]1C=C(C(=C[CH+]1)Br)OC.COC1=C(C=CC=C1)Br
Highest priority first:

Priority: 2950

CC(=O)[C@@H]1C=C(C(=C[CH+:20]1)Br)OC.CO[C:13]1=[C:12]([CH:11]=[CH:10]C=C1)Br>>CC(=O)[C@@H]1C=C(C(=C[CH:20]1[CH:10]2C=C[C+:13]([C:12](=[CH:11]2)Br)OC)Br)OC
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(=O)[C@@H]1C=C(C(=C[CH+:20]1)Br)OC.CO[C:13]1=[C:12]([CH:11]=[CH:10]C=C1)Br>>CC(=O)[C@@H]1C=C(C(=C[CH:20]1[CH:10]2C=C[C+:13]([C:12](=[CH:11]2)Br)OC)Br)OC 10,11=10,20;12,13=11,12

Priority: 2600

CC(=O)[C@@H]1C=C(C(=C[CH+:20]1)Br)OC.CO[C:12]1=[C:13](C=C[CH:10]=[CH:11]1)Br>>CC(=O)[C@@H]1C=C(C(=C[CH:20]1[CH:10]2C=C[C+:13]([C:12](=[CH:11]2)OC)Br)Br)OC
( 4 pi 3 2; 2 pi 1 2 5 p None 0 )
π_C=C > π_C=C > p_C CC(=O)[C@@H]1C=C(C(=C[CH+:20]1)Br)OC.CO[C:12]1=[C:13](C=C[CH:10]=[CH:11]1)Br>>CC(=O)[C@@H]1C=C(C(=C[CH:20]1[CH:10]2C=C[C+:13]([C:12](=[CH:11]2)OC)Br)Br)OC 10,11=10,20;12,13=11,12

Priority: 2000

CC(=O)[C@@H]1C=C(C(=C[CH+:20]1)Br)OC.COC1=C([CH:11]=[CH:10]C=C1)Br>>CC(=O)[C@@H]1C=C(C(=C[CH:20]1[CH:10]2C=CC(=C([CH+:11]2)Br)OC)Br)OC
( 2 pi 1 2 5 p None 0 )
π_C=C > p_C CC(=O)[C@@H]1C=C(C(=C[CH+:20]1)Br)OC.COC1=C([CH:11]=[CH:10]C=C1)Br>>CC(=O)[C@@H]1C=C(C(=C[CH:20]1[CH:10]2C=CC(=C([CH+:11]2)Br)OC)Br)OC 10,11=10,20

Reagent: 8
Reactant Smiles: CCO[C@](C)(OC(=O)C=C)O[C@](C=C)([O-])OC(=O)C
Highest priority first:

Priority: 6983

CCO[C@](C)(OC(=O)C=C)O[C@:20](C=C)([O-:10])[O:21]C(=O)C>>CCO[C@](C)(OC(=O)C=C)O[C@:20](=[O:10])C=C.CC(=O)[O-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CCO[C@](C)(OC(=O)C=C)O[C@:20](C=C)([O-:10])[O:21]C(=O)C>>CCO[C@](C)(OC(=O)C=C)O[C@:20](=[O:10])C=C.CC(=O)[O-:21] 10=20;20,21=21

Priority: 6975

CCO[C@](C)(OC(=O)C=C)[O:21][C@:20](C=C)([O-:10])OC(=O)C>>CCO[C@@](C)([O-:21])OC(=O)C=C.CC(=O)O[C@@:20](=[O:10])C=C
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CCO[C@](C)(OC(=O)C=C)[O:21][C@:20](C=C)([O-:10])OC(=O)C>>CCO[C@@](C)([O-:21])OC(=O)C=C.CC(=O)O[C@@:20](=[O:10])C=C 10=20;20,21=21

Priority: 4448

CCO[C@](C)(O[C:20](=[O:21])C=C)O[C@](C=C)([O-:10])OC(=O)C>>CCO[C@@]1(O[C:20]([O:10][C@](O1)(C=C)OC(=O)C)(C=C)[O-:21])C
( 5 sp3 None 2 1 pi 2 2 )
n_O > π^*_C=O CCO[C@](C)(O[C:20](=[O:21])C=C)O[C@](C=C)([O-:10])OC(=O)C>>CCO[C@@]1(O[C:20]([O:10][C@](O1)(C=C)OC(=O)C)(C=C)[O-:21])C 10=20;20,21=21

Reagent: 8
Reactant Smiles: CC(=O)C[C@]1([C@@H](C(=O)C[C@@](O1)(C)[O-])c2ccccc2)Cc3ccccc3
Highest priority first:

Priority: 6974

CC(=O)C[C@]1([C@@H](C(=O)C[C@@:20]([O:21]1)(C)[O-:10])c2ccccc2)Cc3ccccc3>>C[C@@:20](=[O:10])CC(=O)[C@@H](c1ccccc1)[C@](Cc2ccccc2)(CC(=O)C)[O-:21]
( 2 sp3 None 2 1 sigma 3 2 )
n_O > σ^*_C-O CC(=O)C[C@]1([C@@H](C(=O)C[C@@:20]([O:21]1)(C)[O-:10])c2ccccc2)Cc3ccccc3>>C[C@@:20](=[O:10])CC(=O)[C@@H](c1ccccc1)[C@](Cc2ccccc2)(CC(=O)C)[O-:21] 10=20;20,21=21

Priority: 4446

C[C:20](=[O:21])C[C@]1([C@@H](C(=O)C[C@@](O1)(C)[O-:10])c2ccccc2)Cc3ccccc3>>C[C@@]12CC(=O)[C@H]([C@@](O1)(C[C:20]([O:10]2)(C)[O-:21])Cc3ccccc3)c4ccccc4
( 5 sp3 None 2 1 pi 2 2 )
n_O > π^*_C=O C[C:20](=[O:21])C[C@]1([C@@H](C(=O)C[C@@](O1)(C)[O-:10])c2ccccc2)Cc3ccccc3>>C[C@@]12CC(=O)[C@H]([C@@](O1)(C[C:20]([O:10]2)(C)[O-:21])Cc3ccccc3)c4ccccc4 10=20;20,21=21

Reagent: 28
Reactant Smiles: CC(=O)[C@@H]1C=c2ccccc2=C[C+]1C(=O)C.CC(=O)C1=Cc2ccccc2C=C1
Highest priority first:

Priority: 2741

CC(=O)[C@@H]1C=c2ccccc2=C[C+:20]1C(=O)C.CC(=O)C1=Cc2ccccc2[CH:10]=[CH:11]1>>CC(=O)[C@@H]1C=c2ccccc2=C[C:20]1([CH:10]3[CH+:11]C(=Cc4c3cccc4)C(=O)C)C(=O)C
( 3 pi 2 2 5 p None 0 )
π_C=C > p_C CC(=O)[C@@H]1C=c2ccccc2=C[C+:20]1C(=O)C.CC(=O)C1=Cc2ccccc2[CH:10]=[CH:11]1>>CC(=O)[C@@H]1C=c2ccccc2=C[C:20]1([CH:10]3[CH+:11]C(=Cc4c3cccc4)C(=O)C)C(=O)C 10,11=10,20

Priority: 2540

CC(=O)[C@@H]1C=c2ccccc2=C[C+:20]1C(=O)C.CC(=O)[C:11]1=[CH:10]c2ccccc2C=C1>>CC(=O)[C@@H]1C=c2ccccc2=C[C:20]1([CH:10]3c4ccccc4C=C[C+:11]3C(=O)C)C(=O)C
( 3 pi 2 2 5 p None 0 )
π_C=C > p_C CC(=O)[C@@H]1C=c2ccccc2=C[C+:20]1C(=O)C.CC(=O)[C:11]1=[CH:10]c2ccccc2C=C1>>CC(=O)[C@@H]1C=c2ccccc2=C[C:20]1([CH:10]3c4ccccc4C=C[C+:11]3C(=O)C)C(=O)C 10,11=10,20

Reagent: 66
Reactant Smiles: CCOC1=C[C@@H]([CH+]C=C1)[C@@H]2C=CC(=C[C@H]2C(C)C)OCC
Highest priority first:

Priority: 7084

CCOC1=C[C@@H]([CH+:20]C=C1)[C@@H]2C=C[C:10](=[CH:11][C@H]2C(C)C)OCC>>CCOC1=C[C@@H]2[C@@H]3C=C[C:10]([CH:20]2C=C1)([CH+:11][C@H]3C(C)C)OCC
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CCOC1=C[C@@H]([CH+:20]C=C1)[C@@H]2C=C[C:10](=[CH:11][C@H]2C(C)C)OCC>>CCOC1=C[C@@H]2[C@@H]3C=C[C:10]([CH:20]2C=C1)([CH+:11][C@H]3C(C)C)OCC 10,11=10,20

Priority: 7082

CCOC1=C[C@@H]([CH+:20]C=C1)[C@@H]2[CH:11]=[CH:10]C(=C[C@H]2C(C)C)OCC>>CCOC1=C[C@H]2[CH:20](C=C1)[CH:10]3[CH+:11][C@@H]2[C@@H](C=C3OCC)C(C)C
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CCOC1=C[C@@H]([CH+:20]C=C1)[C@@H]2[CH:11]=[CH:10]C(=C[C@H]2C(C)C)OCC>>CCOC1=C[C@H]2[CH:20](C=C1)[CH:10]3[CH+:11][C@@H]2[C@@H](C=C3OCC)C(C)C 10,11=10,20

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=CC(=C2[C@]1(C=CC=C2)[C@@H]3[CH+]C=Cc4c3cccc4C#N)C#N
Highest priority first:

Priority: 7084

CC(C)[C@@H]1[CH:11]=[CH:10]C(=C2[C@]1(C=CC=C2)[C@@H]3[CH+:20]C=Cc4c3cccc4C#N)C#N>>CC(C)[C@@H]1[CH+:11][CH:10]2[CH:20]3C=Cc4c(cccc4[C@@H]3[C@]15C=CC=CC5=C2C#N)C#N
( 6 pi 5 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1[CH:11]=[CH:10]C(=C2[C@]1(C=CC=C2)[C@@H]3[CH+:20]C=Cc4c3cccc4C#N)C#N>>CC(C)[C@@H]1[CH+:11][CH:10]2[CH:20]3C=Cc4c(cccc4[C@@H]3[C@]15C=CC=CC5=C2C#N)C#N 10,11=10,20

Priority: 7082

CC(C)[C@@H]1C=CC(=C2[C@]1([CH:11]=[CH:10]C=C2)[C@@H]3[CH+:20]C=Cc4c3cccc4C#N)C#N>>CC(C)[C@@H]1C=CC(=C2[C@@]13[CH+:11][CH:10](C=C2)[CH:20]4[C@@H]3c5cccc(c5C=C4)C#N)C#N
( 5 pi 4 2 1 p None 0 )
π_C=C > p_C CC(C)[C@@H]1C=CC(=C2[C@]1([CH:11]=[CH:10]C=C2)[C@@H]3[CH+:20]C=Cc4c3cccc4C#N)C#N>>CC(C)[C@@H]1C=CC(=C2[C@@]13[CH+:11][CH:10](C=C2)[CH:20]4[C@@H]3c5cccc(c5C=C4)C#N)C#N 10,11=10,20

Reagent: 3 Reactant Smiles: CC(=CC1=C[CH+][C@H](C=C1)[C@@]2(C=CC=C[C@H]2C(C)(C)Cc3ccccc3)C=C(C)C)CHighest priority first:

Reagent: 3 Reactant Smiles: C[C@@H](c1ccccc1)[C@@H]2C=CC(=C[C@H]2[C@@H]3C=C(C=C[CH+]3)C=C)C=C.C[C@H]([C@@H]1C=CC(=C[C@H]1[C@@H]2C=C(C=C[CH+]2)C=C)C=C)C3=CC=CC=C3Highest priority first:

Reagent: 8 Reactant Smiles: C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=CC=CC=C4)OC.c1ccc(cc1)[N+]#N.[Cl-]Highest priority first:

Reagent: 3 Reactant Smiles: CC(C)[C@H](c1ccccc1)[C@@H]2C=C[CH+]C=C2C=C(C)C.CC(C)[C@@H]([C@@H]1C=C[CH+]C=C1C=C(C)C)C2=CC=CC=C2Highest priority first:

Reagent: 3 Reactant Smiles: CC(C)[C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH+]2)N)[NH3+].C1=CC=C(C=C1)NHighest priority first:

Reagent: 3 Reactant Smiles: [1H]OS(=O)(=O)O.CC(C)[C@H](c1ccccc1)[C@@H]\2C=CC=C/C2=C\[C+](C)CHighest priority first:

Reagent: 28 Reactant Smiles: C[C+]=O.C1=COC(=C1)C#NHighest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C+](c4c3cccc4)C(F)(F)F)cccc2C(F)(F)F.CC(C)[C@@H]1C=C2C(=C[C@@H]1[C@@H]3C=C[C+](c4c3cccc4)C(F)(F)F)C=CC=C2C(F)(F)FHighest priority first:

Reagent: 27 Reactant Smiles: CCOC(=O)[C@@](Cc1ccccc1)([C@]([OH2+])(O)OCC)N[C@](C)([OH2+])OHighest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@H]1C=CC=C2[C@]1(C=CC=C2C(=O)C)[C@@H]3C=c4c(=C[CH+]3)cccc4C(=O)CHighest priority first:

Reagent: 66 Reactant Smiles: CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+]2)C)C(C)CHighest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@H]1C=CC=C2[C@]1(C=CC(=C2)C(F)(F)F)[C@H]3[CH+]C=Cc4c3ccc(c4)C(F)(F)FHighest priority first:

Reagent: 28 Reactant Smiles: CC(=O)[C@@H]1[CH+]C=Cc2c1cccc2C(F)(F)F.c1ccc2=C(C=CC=c2c1)C(F)(F)FHighest priority first:

Reagent: 3 Reactant Smiles: CC(C)[C@H]1C=CC=C[C@@]1(C=C)[C@@H]2C=CC=C([CH+]2)C=CHighest priority first:

Reagent: 8 Reactant Smiles: C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=CC=CC=C4)OC.c1ccc(cc1)[N+]#N.[Cl-]Highest priority first:

Reagent: 8 Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]Highest priority first:

Reagent: 3 Reactant Smiles: C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C+]2C#C)/C=C/c3ccccc3.C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C+]2C#C)/C=C/C3=CC=CC=C3Highest priority first:

Reagent: 8 Reactant Smiles: CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]Highest priority first:

Reagent: 140 Reactant Smiles: [1H]C1CC[C@H](C1=O)[C@H](C)O.CC[O-]Highest priority first:

Reagent: 8 Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=CC(=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]Highest priority first:

Reagent: 8 Reactant Smiles: CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]Highest priority first:

Reagent: 3 Reactant Smiles: CC[C@@H](c1ccccc1)[C@H]2C=C(C=C[C@@H]2[C@H]3C=CC=C([CH+]3)/C=C/C)/C=C/C.CC[C@H]([C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)C3=CC=CC=C3Highest priority first:

Reagent: 3 Reactant Smiles: CC(C)[C@@H]1C=CC=C[C@]1(C#C)[C@H]2C=CC(=C[CH+]2)C#CHighest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@@H]1C=CC=C2[C@]1(C=CC(=C2)C#N)[C@@H]3[CH+]C=Cc4c3ccc(c4)C#NHighest priority first:

Reagent: 140 Reactant Smiles: [1H]CC(=O)C[C@H](C=C)O.CC[O-]Highest priority first:

Reagent: 3 Reactant Smiles: [1H]OS(=O)(=O)O.CC[O@@H+]CC=C(O)OHighest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@@H]1[C@@H](C2=CC=CC=C2N1)[C@H]3C=CC=C4[C+]3C=CN4Highest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@H]1C=Cc2cccc(c2[CH+]1)Br.CC(C)[C@H]1C=CC2=C([CH+]1)C(=CC=C2)BrHighest priority first:

Reagent: 3 Reactant Smiles: CC[C@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@@H]3C=CC=C([CH+]3)/C=C/C)/C=C/C.CC[C@@H]([C@@H]1C=CC=C([C@H]1[C@@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)C3=CC=CC=C3Highest priority first:

Reagent: 87 Reactant Smiles: [1H]C(c1ccccc1)C(=O)CC(=O)C[C@](C)(CC(=O)Cc2ccccc2)[O-].[OH-]Highest priority first:

Reagent: 3 Reactant Smiles: COC[C@H]1[C@H]2C=C(C=C[C@H]2[C@@H]3[C+]1C=CC=C3)/C=C/OCHighest priority first:

Reagent: 87 Reactant Smiles: [1H]CC(=O)C[C@@]1([C@H](C(=O)C[C@](O1)(C)O)c2ccccc2)Cc3ccccc3.[OH-]Highest priority first:

Reagent: 3 Reactant Smiles: CC(C)[C@@H](c1ccccc1)C2C=CC(C=C2)(C=C(C)C)[C@H]3C=CC=C([CH+]3)C=C(C)C.CC(=CC1=CC=CC=C1)CHighest priority first:

Reagent: 8 Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@H]2C=CC=C[C+]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4O.[Cl-]Highest priority first:

Reagent: 3 Reactant Smiles: CC(C)[C@H]1C=CC=C([C@H]1[C@@H]2C=CC(=C[CH+]2)N)[NH3+]Highest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH+]C=C(O2)C(=O)C)C(=O)C.CC(=O)C1=CC=CO1Highest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH+]3)cccc2C(=O)C.CC(=O)C1=CC=Cc2c1cccc2Highest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@H]1C=CC=C2[C@@]1(C=CC=C2C#N)[C@H]3C=C(c4ccccc4[CH+]3)C#NHighest priority first:

Reagent: 8 Reactant Smiles: c1ccc(cc1)[N+]#N.C1C=C[C@H]([CH+]C1=O)/N=N/C2=CC=CC=C2.[Cl-]Highest priority first:

Reagent: 87 Reactant Smiles: CCOC(=O)C=C.CCOC(=O)[C-](C(=O)C=C)C(=O)OCCHighest priority first:

Reagent: 3 Reactant Smiles: CC(C)[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@H]3C=CC(=C[CH+]3)C=C(C)C)C=C(C)CHighest priority first:

Reagent: 24 Reactant Smiles: CO[C+]1C=C[C@H](C2=CC=CC=C21)Br.[Fe-](Br)(Br)(Br)[Br+]BrHighest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@@H]1C=c2cc[nH]c2=C[C@@H]1[C@@H]3C=Cc4cc[nH]c4[CH+]3.c1ccc2c(c1)C=CN2Highest priority first:

Reagent: 140 Reactant Smiles: CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCCCBr)C(=O)[CH2-])O.CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCCCBr)C(=O)[CH2-])OHighest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+]3)C#N)C#N.c1ccc2c(c1)C=CC=C2C#NHighest priority first:

Reagent: 3 Reactant Smiles: CC[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH+]3)/C=C/C)/C=C/C.CC[C@H]([C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH+]2)/C=C/C)/C=C/C)C3=CC=CC=C3Highest priority first:

Reagent: 66 Reactant Smiles: CC1=CC=C[C+]2C1=CC=C[C@H]2[C@@]3([C@H](C=CC4=CC=CC=C43)C(C)C)CHighest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+]3)C(=O)C)C(=O)C.CC(=O)C1=CC=Cc2c1cccc2Highest priority first:

Reagent: 27 Reactant Smiles: CC[OH+][C+]([C@@](Cc1ccccc1)([C@]([OH2+])(O)OCC)NC(=O)C)OHighest priority first:

Reagent: 8 Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4[CH]S[CH][CH+]4.[Cl-]Highest priority first:

Reagent: 140 Reactant Smiles: CCO[C@@]([C@H](C(=O)Cc1ccccc1)[C@@](CC(=O)Cc2ccccc2)(O)OC)([O-])OCHighest priority first:

Reagent: 3 Reactant Smiles: C[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@@H]3C=CC(=C[CH+]3)C=C)C=C.C=CC1=CC=CC=C1Highest priority first:

Reagent: 3 Reactant Smiles: CC(C)[C@H]1C=CC=C[C@]1(C=C)[C@H]2C=CC(=C[CH+]2)C=CHighest priority first:

Reagent: 8 Reactant Smiles: c1ccc(cc1)C[C@]2([C@@H](C(=O)C[C@@](O2)([O-])Cl)c3ccccc3)CC(=O)ClHighest priority first:

Reagent: 3 Reactant Smiles: C[C@@H]1[C@H]2C=CC=C[C@]2([C@@H]3[C+]1C=CC=C3)C=CHighest priority first:

Reagent: 3 Reactant Smiles: C[C@@H](Cc1ccccc1)[C@@H]2C=CC(=C[C@@H]2[C@@H]3C=CC=C[C+]3CC=C)CC=CHighest priority first:

Reagent: 3 Reactant Smiles: CC(C)C1C=CC(C=C1)(C=C)[C@@H]2C=CC=C([CH+]2)C=CHighest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@@H]1C=c2cc(ccc2=C[C@@H]1[C@@H]3C=c4cc(ccc4=C[CH+]3)C#N)C#N.c1ccc2c(c1)C=CC(=C2)C#NHighest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@@H]1C=c2ccc(cc2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH+]3)[N+](=O)[O-])[N+](=O)[O-].CC(C)[C@@H]1C=C2C=CC(=CC2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH+]3)[N+](=O)[O-])[N+](=O)[O-]Highest priority first:

Reagent: 8 Reactant Smiles: COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]Highest priority first:

Reagent: 5 Reactant Smiles: C[CH+][C@@]([OH2+])(O)OC(=O)CHighest priority first:

Reagent: 8 Reactant Smiles: CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]Highest priority first:

Reagent: 3 Reactant Smiles: C[C@@H]1CCC[C@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C+]3CCCC=C.C=CCCCC1=CC=CC=C1Highest priority first:

Reagent: 3 Reactant Smiles: CC[NH2+][C@]1(CC[C@@](O1)([O-])OCC)ClHighest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@@H]1C=C(C=C2[C@]1(C=CC=C2)[C@H]3C=Cc4cc(ccc4[CH+]3)C(=O)C)C(=O)CHighest priority first:

Reagent: 8 Reactant Smiles: CCO[C@@](CC(=[OH+])Cc1ccccc1)([O-])OC(=O)c2ccccc2Highest priority first:

Reagent: 3 Reactant Smiles: CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)Cc2ccccc2)[C@@H]3C=CC=C[C+]3C=C(C)C)C.CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)CC2=CC=CC=C2)[C@@H]3C=CC=C[C+]3C=C(C)C)CHighest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@@H]1C=C2C3=CC=C[C@]2([C@H]1[CH+]3)C#N.c1cc2c(c(c1)C#N)C=CC=C2Highest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@H]1C=CC=C2[C@@]1(C=C(C=C2)[N+](=O)[O-])[C@H]3[CH+]C=Cc4c3cc(cc4)[N+](=O)[O-]Highest priority first:

Reagent: 87 Reactant Smiles: [1H]CC(=O)[C@@H](CCCCBr)C(=O)C[C@](C)([C@@H](CCCCBr)C(=O)C)O.[OH-]Highest priority first:

Reagent: 3 Reactant Smiles: CO/C=C/C1=CC=C[C@H]([C@@H]1[C@@H]2C=CC=C[C+]2/C=C/OC)[C@H](Cc3ccccc3)OCHighest priority first:

Reagent: 3 Reactant Smiles: C[C@H]1CC[C@]2([C@@H]1C=CC=C2)[C@@H]3C=CC=C([CH+]3)CCC=C.C=CCCC1=CC=CC=C1Highest priority first:

Reagent: 8 Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]Highest priority first:

Reagent: 28 Reactant Smiles: CC(=O)[C@H]1C=Cc2ccc(cc2[CH+]1)Br.CC(=O)[C@H]1C=CC2=CC=C(C=C2[CH+]1)BrHighest priority first:

Reagent: 8 Reactant Smiles: CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]Highest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@@H]1C=CC(=C2[C@@]1(C=CC=C2)[C@@H]3C=C(c4ccccc4[CH+]3)C#N)C#NHighest priority first:

Reagent: 8 Reactant Smiles: C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=CC=CC=C4)N(C)C.c1ccc(cc1)[N+]#N.[Cl-]Highest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@@H]1C=CC(=C([CH+]1)Br)OC.COC1=CC=CC=C1BrHighest priority first:

Reagent: 66 Reactant Smiles: CC(C)[C@H]1C=CC(=C[C@@H]1[C@@H]2C=CC=C[C+]2C(C)C)C(C)CHighest priority first:

Reagent: 3 Reactant Smiles: CO/C=C/[C+]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](Cc3ccccc3)OC)/C=C/OC.CO/C=C/[C+]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](CC3=CC=CC=C3)OC)/C=C/OCHighest priority first:

Reagent: 3
Reactant Smiles: CC(=CC1=C[CH+][C@H](C=C1)[C@@]2(C=CC=C[C@H]2C(C)(C)Cc3ccccc3)C=C(C)C)C
Highest priority first:

Reagent: 3
Reactant Smiles: C[C@@H](c1ccccc1)[C@@H]2C=CC(=C[C@H]2[C@@H]3C=C(C=C[CH+]3)C=C)C=C.C[C@H]([C@@H]1C=CC(=C[C@H]1[C@@H]2C=C(C=C[CH+]2)C=C)C=C)C3=CC=CC=C3
Highest priority first:

Reagent: 8
Reactant Smiles: C[C+]1C=CC(=C[C@@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=CC=CC=C4)OC.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Reagent: 3
Reactant Smiles: CC(C)[C@H](c1ccccc1)[C@@H]2C=C[CH+]C=C2C=C(C)C.CC(C)[C@@H]([C@@H]1C=C[CH+]C=C1C=C(C)C)C2=CC=CC=C2
Highest priority first:

Reagent: 3
Reactant Smiles: CC(C)[C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH+]2)N)[NH3+].C1=CC=C(C=C1)N
Highest priority first:

Reagent: 3
Reactant Smiles: [1H]OS(=O)(=O)O.CC(C)[C@H](c1ccccc1)[C@@H]\2C=CC=C/C2=C\[C+](C)C
Highest priority first:

Reagent: 28
Reactant Smiles: C[C+]=O.C1=COC(=C1)C#N
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=C[C+](c4c3cccc4)C(F)(F)F)cccc2C(F)(F)F.CC(C)[C@@H]1C=C2C(=C[C@@H]1[C@@H]3C=C[C+](c4c3cccc4)C(F)(F)F)C=CC=C2C(F)(F)F
Highest priority first:

Reagent: 27
Reactant Smiles: CCOC(=O)[C@@](Cc1ccccc1)([C@]([OH2+])(O)OCC)N[C@](C)([OH2+])O
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=CC=C2[C@]1(C=CC=C2C(=O)C)[C@@H]3C=c4c(=C[CH+]3)cccc4C(=O)C
Highest priority first:

Reagent: 66
Reactant Smiles: CC1=C[C@@H]([C@H](C=C1)[C@@H]2C=CC=C([CH+]2)C)C(C)C
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=CC=C2[C@]1(C=CC(=C2)C(F)(F)F)[C@H]3[CH+]C=Cc4c3ccc(c4)C(F)(F)F
Highest priority first:

Reagent: 28
Reactant Smiles: CC(=O)[C@@H]1[CH+]C=Cc2c1cccc2C(F)(F)F.c1ccc2=C(C=CC=c2c1)C(F)(F)F
Highest priority first:

Reagent: 3
Reactant Smiles: CC(C)[C@H]1C=CC=C[C@@]1(C=C)[C@@H]2C=CC=C([CH+]2)C=C
Highest priority first:

Reagent: 8
Reactant Smiles: C[C+]1C=CC(=C[C@H]1/N=N/C2=CC=C[C@@H]([CH+]2)/N=N/C3=C[C@H]([CH+]C=C3)/N=N/C4=CC=CC=C4)OC.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]
Highest priority first:

Reagent: 3
Reactant Smiles: C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C+]2C#C)/C=C/c3ccccc3.C#CC1=CC=C[C@@H]([C@H]1[C@@H]2C=CC=C[C+]2C#C)/C=C/C3=CC=CC=C3
Highest priority first:

Reagent: 8
Reactant Smiles: CN(C)C1=C[CH+][C@H](C=C1)/N=N/C2=C[C@H]([CH+]C=C2)/N=N/C3=CC=C[C@@H]([CH+]3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Reagent: 140
Reactant Smiles: [1H]C1CC[C@H](C1=O)[C@H](C)O.CC[O-]
Highest priority first:

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=CC(=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4C=CS[CH+]4.[Cl-]
Highest priority first:

Reagent: 8
Reactant Smiles: CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=CC=C[C@H]([CH+]3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Reagent: 3
Reactant Smiles: CC[C@@H](c1ccccc1)[C@H]2C=C(C=C[C@@H]2[C@H]3C=CC=C([CH+]3)/C=C/C)/C=C/C.CC[C@H]([C@H]1C=C(C=C[C@@H]1[C@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)C3=CC=CC=C3
Highest priority first:

Reagent: 3
Reactant Smiles: CC(C)[C@@H]1C=CC=C[C@]1(C#C)[C@H]2C=CC(=C[CH+]2)C#C
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=CC=C2[C@]1(C=CC(=C2)C#N)[C@@H]3[CH+]C=Cc4c3ccc(c4)C#N
Highest priority first:

Reagent: 140
Reactant Smiles: [1H]CC(=O)C[C@H](C=C)O.CC[O-]
Highest priority first:

Reagent: 3
Reactant Smiles: [1H]OS(=O)(=O)O.CC[O@@H+]CC=C(O)O
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1[C@@H](C2=CC=CC=C2N1)[C@H]3C=CC=C4[C+]3C=CN4
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=Cc2cccc(c2[CH+]1)Br.CC(C)[C@H]1C=CC2=C([CH+]1)C(=CC=C2)Br
Highest priority first:

Reagent: 3
Reactant Smiles: CC[C@H](c1ccccc1)[C@@H]2C=CC=C([C@H]2[C@@H]3C=CC=C([CH+]3)/C=C/C)/C=C/C.CC[C@@H]([C@@H]1C=CC=C([C@H]1[C@@H]2C=CC=C([CH+]2)/C=C/C)/C=C/C)C3=CC=CC=C3
Highest priority first:

Reagent: 87
Reactant Smiles: [1H]C(c1ccccc1)C(=O)CC(=O)C[C@](C)(CC(=O)Cc2ccccc2)[O-].[OH-]
Highest priority first:

Reagent: 3
Reactant Smiles: COC[C@H]1[C@H]2C=C(C=C[C@H]2[C@@H]3[C+]1C=CC=C3)/C=C/OC
Highest priority first:

Reagent: 87
Reactant Smiles: [1H]CC(=O)C[C@@]1([C@H](C(=O)C[C@](O1)(C)O)c2ccccc2)Cc3ccccc3.[OH-]
Highest priority first:

Reagent: 3
Reactant Smiles: CC(C)[C@@H](c1ccccc1)C2C=CC(C=C2)(C=C(C)C)[C@H]3C=CC=C([CH+]3)C=C(C)C.CC(=CC1=CC=CC=C1)C
Highest priority first:

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@H]2C=CC=C[C+]2/N=N/[C@@H]3C=C(C=C[CH+]3)/N=N/[C@@H]4C=CC=C[C+]4O.[Cl-]
Highest priority first:

Reagent: 3
Reactant Smiles: CC(C)[C@H]1C=CC=C([C@H]1[C@@H]2C=CC(=C[CH+]2)N)[NH3+]
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1[CH]O[C]([C@H]1[C@@H]2[CH+]C=C(O2)C(=O)C)C(=O)C.CC(=O)C1=CC=CO1
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2c(=C[C@@H]1[C@@H]3C=Cc4c(cccc4C(=O)C)[CH+]3)cccc2C(=O)C.CC(=O)C1=CC=Cc2c1cccc2
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=CC=C2[C@@]1(C=CC=C2C#N)[C@H]3C=C(c4ccccc4[CH+]3)C#N
Highest priority first:

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1C=C[C@H]([CH+]C1=O)/N=N/C2=CC=CC=C2.[Cl-]
Highest priority first:

Reagent: 87
Reactant Smiles: CCOC(=O)C=C.CCOC(=O)[C-](C(=O)C=C)C(=O)OCC
Highest priority first:

Reagent: 3
Reactant Smiles: CC(C)[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@H]3C=CC(=C[CH+]3)C=C(C)C)C=C(C)C
Highest priority first:

Reagent: 24
Reactant Smiles: CO[C+]1C=C[C@H](C2=CC=CC=C21)Br.[Fe-](Br)(Br)(Br)[Br+]Br
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2cc[nH]c2=C[C@@H]1[C@@H]3C=Cc4cc[nH]c4[CH+]3.c1ccc2c(c1)C=CN2
Highest priority first:

Reagent: 140
Reactant Smiles: CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCCCBr)C(=O)[CH2-])O.CC(=O)[C@H](CCCCBr)C(=O)C[C@](C)([C@H](CCCCBr)C(=O)[CH2-])O
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+]3)C#N)C#N.c1ccc2c(c1)C=CC=C2C#N
Highest priority first:

Reagent: 3
Reactant Smiles: CC[C@@H](c1ccccc1)[C@@H]2C=CC=C([C@@H]2[C@@H]3C=CC(=C[CH+]3)/C=C/C)/C=C/C.CC[C@H]([C@@H]1C=CC=C([C@@H]1[C@@H]2C=CC(=C[CH+]2)/C=C/C)/C=C/C)C3=CC=CC=C3
Highest priority first:

Reagent: 66
Reactant Smiles: CC1=CC=C[C+]2C1=CC=C[C@H]2[C@@]3([C@H](C=CC4=CC=CC=C43)C(C)C)C
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2ccccc2=C([C@@H]1[C@@H]3C=c4cccc(c4=C[CH+]3)C(=O)C)C(=O)C.CC(=O)C1=CC=Cc2c1cccc2
Highest priority first:

Reagent: 27
Reactant Smiles: CC[OH+][C+]([C@@](Cc1ccccc1)([C@]([OH2+])(O)OCC)NC(=O)C)O
Highest priority first:

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=CC=C[C+]2/N=N/[C@@H]3C=CC=C[C+]3/N=N/[C@@H]4[CH]S[CH][CH+]4.[Cl-]
Highest priority first:

Reagent: 140
Reactant Smiles: CCO[C@@]([C@H](C(=O)Cc1ccccc1)[C@@](CC(=O)Cc2ccccc2)(O)OC)([O-])OC
Highest priority first:

Reagent: 3
Reactant Smiles: C[C@H](c1ccccc1)[C@H]2C=CC(=C[C@@H]2[C@@H]3C=CC(=C[CH+]3)C=C)C=C.C=CC1=CC=CC=C1
Highest priority first:

Reagent: 3
Reactant Smiles: CC(C)[C@H]1C=CC=C[C@]1(C=C)[C@H]2C=CC(=C[CH+]2)C=C
Highest priority first:

Reagent: 8
Reactant Smiles: c1ccc(cc1)C[C@]2([C@@H](C(=O)C[C@@](O2)([O-])Cl)c3ccccc3)CC(=O)Cl
Highest priority first:

Reagent: 3
Reactant Smiles: C[C@@H]1[C@H]2C=CC=C[C@]2([C@@H]3[C+]1C=CC=C3)C=C
Highest priority first:

Reagent: 3
Reactant Smiles: C[C@@H](Cc1ccccc1)[C@@H]2C=CC(=C[C@@H]2[C@@H]3C=CC=C[C+]3CC=C)CC=C
Highest priority first:

Reagent: 3
Reactant Smiles: CC(C)C1C=CC(C=C1)(C=C)[C@@H]2C=CC=C([CH+]2)C=C
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2cc(ccc2=C[C@@H]1[C@@H]3C=c4cc(ccc4=C[CH+]3)C#N)C#N.c1ccc2c(c1)C=CC(=C2)C#N
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=c2ccc(cc2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH+]3)[N+](=O)[O-])[N+](=O)[O-].CC(C)[C@@H]1C=C2C=CC(=CC2=C[C@H]1[C@@H]3C=c4ccc(cc4=C[CH+]3)[N+](=O)[O-])[N+](=O)[O-]
Highest priority first:

Reagent: 8
Reactant Smiles: COC1=C[CH+][C@@H](C=C1)/N=N/[C+]2C=CC=C[C@H]2/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Reagent: 5
Reactant Smiles: C[CH+][C@@]([OH2+])(O)OC(=O)C
Highest priority first:

Reagent: 8
Reactant Smiles: CN(C)C1=C[CH+][C@H](C=C1)/N=N/[C+]2C=CC(C=C2)/N=N/C3=C[CH+][C@@H](C=C3)/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Reagent: 3
Reactant Smiles: C[C@@H]1CCC[C@]2([C@H]1C=CC=C2)[C@H]3C=CC=C[C+]3CCCC=C.C=CCCCC1=CC=CC=C1
Highest priority first:

Reagent: 3
Reactant Smiles: CC[NH2+][C@]1(CC[C@@](O1)([O-])OCC)Cl
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=C(C=C2[C@]1(C=CC=C2)[C@H]3C=Cc4cc(ccc4[CH+]3)C(=O)C)C(=O)C
Highest priority first:

Reagent: 8
Reactant Smiles: CCO[C@@](CC(=[OH+])Cc1ccccc1)([O-])OC(=O)c2ccccc2
Highest priority first:

Reagent: 3
Reactant Smiles: CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)Cc2ccccc2)[C@@H]3C=CC=C[C+]3C=C(C)C)C.CC(=CC1=C[C@H]([C@@H](C=C1)C(C)(C)CC2=CC=CC=C2)[C@@H]3C=CC=C[C+]3C=C(C)C)C
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=C2C3=CC=C[C@]2([C@H]1[CH+]3)C#N.c1cc2c(c(c1)C#N)C=CC=C2
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=CC=C2[C@@]1(C=C(C=C2)[N+](=O)[O-])[C@H]3[CH+]C=Cc4c3cc(cc4)[N+](=O)[O-]
Highest priority first:

Reagent: 87
Reactant Smiles: [1H]CC(=O)[C@@H](CCCCBr)C(=O)C[C@](C)([C@@H](CCCCBr)C(=O)C)O.[OH-]
Highest priority first:

Reagent: 3
Reactant Smiles: CO/C=C/C1=CC=C[C@H]([C@@H]1[C@@H]2C=CC=C[C+]2/C=C/OC)[C@H](Cc3ccccc3)OC
Highest priority first:

Reagent: 3
Reactant Smiles: C[C@H]1CC[C@]2([C@@H]1C=CC=C2)[C@@H]3C=CC=C([CH+]3)CCC=C.C=CCCC1=CC=CC=C1
Highest priority first:

Reagent: 8
Reactant Smiles: c1ccc(cc1)[N+]#N.C1=CC=C(C=C1)/N=N/[C@@H]2C=C(C=C[CH+]2)/N=N/[C@H]3C=CC(=C[CH+]3)/N=N/[C@@H]4[CH+]C=CS4.[Cl-]
Highest priority first:

Reagent: 28
Reactant Smiles: CC(=O)[C@H]1C=Cc2ccc(cc2[CH+]1)Br.CC(=O)[C@H]1C=CC2=CC=C(C=C2[CH+]1)Br
Highest priority first:

Reagent: 8
Reactant Smiles: CN(C)[C+]1C=CC(C=C1)/N=N/C2=CC=C[C@H]([CH+]2)/N=N/[C+]3C=CC=C[C@@H]3/N=N/C4=CC=CC=C4.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=CC(=C2[C@@]1(C=CC=C2)[C@@H]3C=C(c4ccccc4[CH+]3)C#N)C#N
Highest priority first:

Reagent: 8
Reactant Smiles: C[C+]1C=CC(=C[C@H]1/N=N/C2=C[CH+][C@@H](C=C2)/N=N/[C+]3C=CC(C=C3)/N=N/C4=CC=CC=C4)N(C)C.c1ccc(cc1)[N+]#N.[Cl-]
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@@H]1C=CC(=C([CH+]1)Br)OC.COC1=CC=CC=C1Br
Highest priority first:

Reagent: 66
Reactant Smiles: CC(C)[C@H]1C=CC(=C[C@@H]1[C@@H]2C=CC=C[C+]2C(C)C)C(C)C
Highest priority first:

Reagent: 3
Reactant Smiles: CO/C=C/[C+]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](Cc3ccccc3)OC)/C=C/OC.CO/C=C/[C+]1C=CC(C=C1)C2(C=CC(C=C2)[C@H](CC3=CC=CC=C3)OC)/C=C/OC
Highest priority first: