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

Systemtic Name: 2-[[2-(4-aminophenyl)-3H-benzimidazol-1-ium-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[2-(4-aminophenyl)-3H-benzimidazol-1-ium-1-yl]methyl]benzonitrile CAS Name: 2-[[2-(4-aminophenyl)-3H-benzimidazol-1-ium-1-yl]methyl]benzonitrile IUPAC Name: 2-[[2-(4-aminophenyl)-3H-benzimidazol-1-ium-1-yl]methyl]benzonitrile Traditional Name: 2-[[2-(4-aminophenyl)-3H-benzimidazol-1-ium-1-yl]methyl]benzonitrile Formula: C21H17N4+ MolecularWeight: 325.38648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C[N+]2=C(NC3=CC=CC=C32)C4=CC=C(C=C4)N)C#N

Isomeric SMILES

C1=CC=C(C(=C1)C[N+]2=C(NC3=CC=CC=C32)C4=CC=C(C=C4)N)C#N

InChI

InChI=1S/C21H16N4/c22-13-16-5-1-2-6-17(16)14-25-20-8-4-3-7-19(20)24-21(25)15-9-11-18(23)12-10-15/h1-12H,14H2,(H2,23,24)/p+1