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

Systemtic Name: 2-(2-chloroethyl)-1-[(2-methoxy-5-nitro-phenyl)amino]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-(2-chloroethyl)-1-(2-methoxy-5-nitro-anilino)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 2-(2-chloroethyl)-1-(2-methoxy-5-nitroanilino)-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-(2-chloroethyl)-1-(2-methoxy-5-nitroanilino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-(2-chloroethyl)-1-(2-methoxy-5-nitro-anilino)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C22H18ClN5O3 MolecularWeight: 435.86302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCCl)NC4=C(C=CC(=C4)[N+](=O)[O-])OC)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCCl)NC4=C(C=CC(=C4)[N+](=O)[O-])OC)C#N

InChI

InChI=1S/C22H18ClN5O3/c1-13-15(9-10-23)21(26-18-11-14(28(29)30)7-8-20(18)31-2)27-19-6-4-3-5-17(19)25-22(27)16(13)12-24/h3-8,11,26H,9-10H2,1-2H3