(3S)-N-(2-acetamidoethyl)-1-[(4-chlorophenyl)methyl]-6-oxidanylidene-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(2-acetamidoethyl)-1-[(4-chlorophenyl)methyl]-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: (3S)-N-(2-acetamidoethyl)-1-[(4-chlorophenyl)methyl]-6-oxo-piperidine-3-carboxamide CAS Name: (3S)-N-(2-acetamidoethyl)-1-[(4-chlorophenyl)methyl]-6-oxo-3-piperidinecarboxamide IUPAC Name: (3S)-N-(2-acetamidoethyl)-1-[(4-chlorophenyl)methyl]-6-oxopiperidine-3-carboxamide Traditional Name: (3S)-N-(2-acetamidoethyl)-1-(4-chlorobenzyl)-6-keto-nipecotamide Formula: C17H22ClN3O3 MolecularWeight: 351.82788

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1CCC(=O)N(C1)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=O)NCCNC(=O)[C@H]1CCC(=O)N(C1)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H22ClN3O3/c1-12(22)19-8-9-20-17(24)14-4-7-16(23)21(11-14)10-13-2-5-15(18)6-3-13/h2-3,5-6,14H,4,7-11H2,1H3,(H,19,22)(H,20,24)/t14-/m0/s1