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

Systemtic Name: 2-[(4-chlorophenyl)methyl]-1-[(2-methoxy-5-nitro-phenyl)amino]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-[(4-chlorophenyl)methyl]-1-(2-methoxy-5-nitro-anilino)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 2-[(4-chlorophenyl)methyl]-1-(2-methoxy-5-nitroanilino)-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-[(4-chlorophenyl)methyl]-1-(2-methoxy-5-nitroanilino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-(4-chlorobenzyl)-1-(2-methoxy-5-nitro-anilino)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C27H20ClN5O3 MolecularWeight: 497.9324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC4=CC=C(C=C4)Cl)NC5=C(C=CC(=C5)[N+](=O)[O-])OC)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC4=CC=C(C=C4)Cl)NC5=C(C=CC(=C5)[N+](=O)[O-])OC)C#N

InChI

InChI=1S/C27H20ClN5O3/c1-16-20(13-17-7-9-18(28)10-8-17)26(31-23-14-19(33(34)35)11-12-25(23)36-2)32-24-6-4-3-5-22(24)30-27(32)21(16)15-29/h3-12,14,31H,13H2,1-2H3