(3S)-N-[(2-chlorophenyl)methyl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(2-chlorophenyl)methyl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(benzenesulfonyl)-N-[(2-chlorophenyl)methyl]piperidine-3-carboxamide CAS Name: (3S)-1-(benzenesulfonyl)-N-[(2-chlorophenyl)methyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(benzenesulfonyl)-N-[(2-chlorophenyl)methyl]piperidine-3-carboxamide Traditional Name: (3S)-1-besyl-N-(2-chlorobenzyl)nipecotamide Formula: C19H21ClN2O3S MolecularWeight: 392.89964

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3Cl

InChI

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