1-(benzimidazol-1-yl)-3-methyl-2-(phenylmethyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile

Systemtic Name: 1-(benzimidazol-1-yl)-3-methyl-2-(phenylmethyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 1-(benzimidazol-1-yl)-2-benzyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 1-(1-benzimidazolyl)-3-methyl-2-(phenylmethyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 1-(benzimidazol-1-yl)-2-benzyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 1-(benzimidazol-1-yl)-2-benzyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C27H20N5+ MolecularWeight: 414.4812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=[N+](C3=CC=CC=C3N2)C(=C1CC4=CC=CC=C4)N5C=NC6=CC=CC=C65)C#N

Isomeric SMILES

CC1=C(C2=[N+](C3=CC=CC=C3N2)C(=C1CC4=CC=CC=C4)N5C=NC6=CC=CC=C65)C#N

InChI

InChI=1S/C27H19N5/c1-18-20(15-19-9-3-2-4-10-19)27(31-17-29-22-11-5-7-13-24(22)31)32-25-14-8-6-12-23(25)30-26(32)21(18)16-28/h2-14,17H,15H2,1H3/p+1