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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C(=C(C3=NC4=CC=CC=C4N23)C#N)C)CC5=CC=C(C=C5)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C(=C(C3=NC4=CC=CC=C4N23)C#N)C)CC5=CC=C(C=C5)C

InChI

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