1-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-3-methyl-2-(phenylmethyl)pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-3-methyl-2-(phenylmethyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-benzyl-1-(5-methoxy-2-methyl-4-nitro-anilino)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-(5-methoxy-2-methyl-4-nitroanilino)-3-methyl-2-(phenylmethyl)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-benzyl-1-(5-methoxy-2-methyl-4-nitroanilino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-benzyl-1-(5-methoxy-2-methyl-4-nitro-anilino)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C28H23N5O3 MolecularWeight: 477.51392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC2=C(C(=C(C3=NC4=CC=CC=C4N23)C#N)C)CC5=CC=CC=C5)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1NC2=C(C(=C(C3=NC4=CC=CC=C4N23)C#N)C)CC5=CC=CC=C5)OC)[N+](=O)[O-]

InChI

InChI=1S/C28H23N5O3/c1-17-13-25(33(34)35)26(36-3)15-23(17)31-27-20(14-19-9-5-4-6-10-19)18(2)21(16-29)28-30-22-11-7-8-12-24(22)32(27)28/h4-13,15,31H,14H2,1-3H3