(3S)-N-[(4-chlorophenyl)methyl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(4-chlorophenyl)methyl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(benzenesulfonyl)-N-[(4-chlorophenyl)methyl]piperidine-3-carboxamide CAS Name: (3S)-1-(benzenesulfonyl)-N-[(4-chlorophenyl)methyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(benzenesulfonyl)-N-[(4-chlorophenyl)methyl]piperidine-3-carboxamide Traditional Name: (3S)-1-besyl-N-(4-chlorobenzyl)nipecotamide Formula: C19H21ClN2O3S MolecularWeight: 392.89964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H21ClN2O3S/c20-17-10-8-15(9-11-17)13-21-19(23)16-5-4-12-22(14-16)26(24,25)18-6-2-1-3-7-18/h1-3,6-11,16H,4-5,12-14H2,(H,21,23)/t16-/m0/s1