4-[[2-(4-aminophenyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[2-(4-aminophenyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[2-(4-aminophenyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]methyl]benzonitrile CAS Name: 4-[[2-(4-aminophenyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]methyl]benzonitrile IUPAC Name: 4-[[2-(4-aminophenyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]methyl]benzonitrile Traditional Name: 4-[[2-(4-aminophenyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]methyl]benzonitrile Formula: C23H21N4+ MolecularWeight: 353.43964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)[N+](=C(N2)C3=CC=C(C=C3)N)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC2=C(C=C1C)[N+](=C(N2)C3=CC=C(C=C3)N)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H20N4/c1-15-11-21-22(12-16(15)2)27(14-18-5-3-17(13-24)4-6-18)23(26-21)19-7-9-20(25)10-8-19/h3-12H,14H2,1-2H3,(H2,25,26)/p+1