(3S)-N-(5-chloranyl-2-methoxy-phenyl)-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-(5-chloranyl-2-methoxy-phenyl)-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(benzenesulfonyl)-N-(5-chloro-2-methoxy-phenyl)piperidine-3-carboxamide CAS Name: (3S)-1-(benzenesulfonyl)-N-(5-chloro-2-methoxyphenyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(benzenesulfonyl)-N-(5-chloro-2-methoxyphenyl)piperidine-3-carboxamide Traditional Name: (3S)-1-besyl-N-(5-chloro-2-methoxy-phenyl)nipecotamide Formula: C19H21ClN2O4S MolecularWeight: 408.89904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21ClN2O4S/c1-26-18-10-9-15(20)12-17(18)21-19(23)14-6-5-11-22(13-14)27(24,25)16-7-3-2-4-8-16/h2-4,7-10,12,14H,5-6,11,13H2,1H3,(H,21,23)/t14-/m0/s1