1-[(4-methoxyphenyl)amino]-3-methyl-2-octyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[(4-methoxyphenyl)amino]-3-methyl-2-octyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-(4-methoxyanilino)-3-methyl-2-octyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-(4-methoxyanilino)-3-methyl-2-octyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-(4-methoxyanilino)-3-methyl-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-methyl-2-octyl-1-(p-anisidino)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C28H32N4O MolecularWeight: 440.57988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NC4=CC=C(C=C4)OC

Isomeric SMILES

CCCCCCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C28H32N4O/c1-4-5-6-7-8-9-12-23-20(2)24(19-29)28-31-25-13-10-11-14-26(25)32(28)27(23)30-21-15-17-22(33-3)18-16-21/h10-11,13-18,30H,4-9,12H2,1-3H3