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

Systemtic Name: 3-methyl-2-(phenylmethyl)-1-[(phenylmethyl)amino]-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 2-benzyl-1-(benzylamino)-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 3-methyl-2-(phenylmethyl)-1-[(phenylmethyl)amino]-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 2-benzyl-1-(benzylamino)-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 2-benzyl-1-(benzylamino)-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C27H23N4+ MolecularWeight: 403.49832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=[N+](C3=CC=CC=C3N2)C(=C1CC4=CC=CC=C4)NCC5=CC=CC=C5)C#N

Isomeric SMILES

CC1=C(C2=[N+](C3=CC=CC=C3N2)C(=C1CC4=CC=CC=C4)NCC5=CC=CC=C5)C#N

InChI

InChI=1S/C27H22N4/c1-19-22(16-20-10-4-2-5-11-20)26(29-18-21-12-6-3-7-13-21)31-25-15-9-8-14-24(25)30-27(31)23(19)17-28/h2-15H,16,18H2,1H3,(H,29,30)/p+1