(3S)-1-(4-chlorophenyl)carbonyl-N-(2-ethanoylphenyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-chlorophenyl)carbonyl-N-(2-ethanoylphenyl)piperidine-3-carboxamide Openeye Name: (3S)-N-(2-acetylphenyl)-1-(4-chlorobenzoyl)piperidine-3-carboxamide CAS Name: (3S)-N-(2-acetylphenyl)-1-[(4-chlorophenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-(2-acetylphenyl)-1-(4-chlorobenzoyl)piperidine-3-carboxamide Traditional Name: (3S)-N-(2-acetylphenyl)-1-(4-chlorobenzoyl)nipecotamide Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)C1=CC=CC=C1NC(=O)[C@H]2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H21ClN2O3/c1-14(25)18-6-2-3-7-19(18)23-20(26)16-5-4-12-24(13-16)21(27)15-8-10-17(22)11-9-15/h2-3,6-11,16H,4-5,12-13H2,1H3,(H,23,26)/t16-/m0/s1