ethyl 1-[4-cyano-3-methyl-2-[(2-methylphenyl)methyl]pyrido[1,2-a]benzimidazol-1-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-cyano-3-methyl-2-[(2-methylphenyl)methyl]pyrido[1,2-a]benzimidazol-1-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[4-cyano-3-methyl-2-(o-tolylmethyl)pyrido[1,2-a]benzimidazol-1-yl]piperidine-4-carboxylate CAS Name: 1-[4-cyano-3-methyl-2-[(2-methylphenyl)methyl]-1-pyrido[1,2-a]benzimidazolyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-cyano-3-methyl-2-[(2-methylphenyl)methyl]pyrido[1,2-a]benzimidazol-1-yl]piperidine-4-carboxylate Traditional Name: 1-[4-cyano-3-methyl-2-(2-methylbenzyl)pyrido[1,2-a]benzimidazol-1-yl]isonipecotic acid ethyl ester Formula: C29H30N4O2 MolecularWeight: 466.5741

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C(=C(C3=NC4=CC=CC=C4N23)C#N)C)CC5=CC=CC=C5C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C(=C(C3=NC4=CC=CC=C4N23)C#N)C)CC5=CC=CC=C5C

InChI

InChI=1S/C29H30N4O2/c1-4-35-29(34)21-13-15-32(16-14-21)28-23(17-22-10-6-5-9-19(22)2)20(3)24(18-30)27-31-25-11-7-8-12-26(25)33(27)28/h5-12,21H,4,13-17H2,1-3H3