(3S)-N-[1-(3-chloranyl-2-methyl-phenyl)sulfonylpiperidin-3-yl]-3-methoxy-cyclohexane-1-carboxamide

Systemtic Name: (3S)-N-[1-(3-chloranyl-2-methyl-phenyl)sulfonylpiperidin-3-yl]-3-methoxy-cyclohexane-1-carboxamide Openeye Name: (3S)-N-[1-(3-chloro-2-methyl-phenyl)sulfonyl-3-piperidyl]-3-methoxy-cyclohexanecarboxamide CAS Name: (3S)-N-[1-(3-chloro-2-methylphenyl)sulfonyl-3-piperidinyl]-3-methoxy-1-cyclohexanecarboxamide IUPAC Name: (3S)-N-[1-(3-chloro-2-methylphenyl)sulfonylpiperidin-3-yl]-3-methoxycyclohexane-1-carboxamide Traditional Name: (3S)-N-[1-(3-chloro-2-methyl-phenyl)sulfonyl-3-piperidyl]-3-methoxy-cyclohexanecarboxamide Formula: C20H29ClN2O4S MolecularWeight: 428.97326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)S(=O)(=O)N2CCCC(C2)NC(=O)C3CCCC(C3)OC

Isomeric SMILES

CC1=C(C=CC=C1Cl)S(=O)(=O)N2CCCC(C2)NC(=O)C3CCC[C@@H](C3)OC

InChI

InChI=1S/C20H29ClN2O4S/c1-14-18(21)9-4-10-19(14)28(25,26)23-11-5-7-16(13-23)22-20(24)15-6-3-8-17(12-15)27-2/h4,9-10,15-17H,3,5-8,11-13H2,1-2H3,(H,22,24)/t15?,16?,17-/m0/s1