N-[1-(3-chlorophenyl)propan-2-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[1-(3-chlorophenyl)propan-2-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[2-(3-chlorophenyl)-1-methyl-ethyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[1-(3-chlorophenyl)propan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[1-(3-chlorophenyl)propan-2-yl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[2-(3-chlorophenyl)-1-methyl-ethyl]isonipecotamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=CC=C1)Cl)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(CC1=CC(=CC=C1)Cl)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25ClN2O3S/c1-16(14-17-6-5-7-19(22)15-17)23-21(25)18-10-12-24(13-11-18)28(26,27)20-8-3-2-4-9-20/h2-9,15-16,18H,10-14H2,1H3,(H,23,25)