N-[3-cyano-1-(phenylmethyl)piperidin-2-yl]-3-methyl-benzamide

Systemtic Name: N-[3-cyano-1-(phenylmethyl)piperidin-2-yl]-3-methyl-benzamide Openeye Name: N-(1-benzyl-3-cyano-2-piperidyl)-3-methyl-benzamide CAS Name: N-[3-cyano-1-(phenylmethyl)-2-piperidinyl]-3-methylbenzamide IUPAC Name: N-(1-benzyl-3-cyanopiperidin-2-yl)-3-methylbenzamide Traditional Name: N-(1-benzyl-3-cyano-2-piperidyl)-3-methyl-benzamide Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2C(CCCN2CC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2C(CCCN2CC3=CC=CC=C3)C#N

InChI

InChI=1S/C21H23N3O/c1-16-7-5-10-18(13-16)21(25)23-20-19(14-22)11-6-12-24(20)15-17-8-3-2-4-9-17/h2-5,7-10,13,19-20H,6,11-12,15H2,1H3,(H,23,25)