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

Systemtic Name: 1-(cyclohexylamino)-3-methyl-2-[(4-methylphenyl)methyl]-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 1-(cyclohexylamino)-3-methyl-2-(p-tolylmethyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 1-(cyclohexylamino)-3-methyl-2-[(4-methylphenyl)methyl]-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 1-(cyclohexylamino)-3-methyl-2-[(4-methylphenyl)methyl]-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 1-(cyclohexylamino)-3-methyl-2-(4-methylbenzyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C27H29N4+ MolecularWeight: 409.54596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=C([N+]3=C(C(=C2C)C#N)NC4=CC=CC=C43)NC5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)CC2=C([N+]3=C(C(=C2C)C#N)NC4=CC=CC=C43)NC5CCCCC5

InChI

InChI=1S/C27H28N4/c1-18-12-14-20(15-13-18)16-22-19(2)23(17-28)27-30-24-10-6-7-11-25(24)31(27)26(22)29-21-8-4-3-5-9-21/h6-7,10-15,21H,3-5,8-9,16H2,1-2H3,(H,29,30)/p+1