N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-[4-(phenylcarbonyl)piperidin-1-yl]ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-[4-(phenylcarbonyl)piperidin-1-yl]ethanamide Openeye Name: 2-(4-benzoyl-1-piperidyl)-N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)acetamide CAS Name: 2-(4-benzoyl-1-piperidinyl)-N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)acetamide IUPAC Name: 2-(4-benzoylpiperidin-1-yl)-N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)acetamide Traditional Name: 2-(4-benzoylpiperidino)-N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)acetamide Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CCC#N)C(=O)CN2CCC(CC2)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CCC#N)C(=O)CN2CCC(CC2)C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C25H29N3O2/c1-19-15-20(2)17-23(16-19)28(12-6-11-26)24(29)18-27-13-9-22(10-14-27)25(30)21-7-4-3-5-8-21/h3-5,7-8,15-17,22H,6,9-10,12-14,18H2,1-2H3