(3R)-1-(3-chloranyl-4-methoxy-phenyl)sulfonyl-N-(phenylmethyl)piperidine-3-carboxamide

Systemtic Name: (3R)-1-(3-chloranyl-4-methoxy-phenyl)sulfonyl-N-(phenylmethyl)piperidine-3-carboxamide Openeye Name: (3R)-N-benzyl-1-(3-chloro-4-methoxy-phenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3R)-1-(3-chloro-4-methoxyphenyl)sulfonyl-N-(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: (3R)-N-benzyl-1-(3-chloro-4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-benzyl-1-(3-chloro-4-methoxy-phenyl)sulfonyl-nipecotamide Formula: C20H23ClN2O4S MolecularWeight: 422.92562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=CC=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)NCC3=CC=CC=C3)Cl

InChI

InChI=1S/C20H23ClN2O4S/c1-27-19-10-9-17(12-18(19)21)28(25,26)23-11-5-8-16(14-23)20(24)22-13-15-6-3-2-4-7-15/h2-4,6-7,9-10,12,16H,5,8,11,13-14H2,1H3,(H,22,24)/t16-/m1/s1