(3S)-1-(5-chloranyl-2-ethoxy-phenyl)sulfonyl-N-[(2S)-4-phenylbutan-2-yl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(5-chloranyl-2-ethoxy-phenyl)sulfonyl-N-[(2S)-4-phenylbutan-2-yl]piperidine-3-carboxamide Openeye Name: (3S)-1-(5-chloro-2-ethoxy-phenyl)sulfonyl-N-[(1S)-1-methyl-3-phenyl-propyl]piperidine-3-carboxamide CAS Name: (3S)-1-(5-chloro-2-ethoxyphenyl)sulfonyl-N-[(2S)-4-phenylbutan-2-yl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(5-chloro-2-ethoxyphenyl)sulfonyl-N-[(2S)-4-phenylbutan-2-yl]piperidine-3-carboxamide Traditional Name: (3S)-1-(5-chloro-2-ethoxy-phenyl)sulfonyl-N-[(1S)-1-methyl-3-phenyl-propyl]nipecotamide Formula: C24H31ClN2O4S MolecularWeight: 479.03194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CCCC(C2)C(=O)NC(C)CCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CCC[C@@H](C2)C(=O)N[C@@H](C)CCC3=CC=CC=C3

InChI

InChI=1S/C24H31ClN2O4S/c1-3-31-22-14-13-21(25)16-23(22)32(29,30)27-15-7-10-20(17-27)24(28)26-18(2)11-12-19-8-5-4-6-9-19/h4-6,8-9,13-14,16,18,20H,3,7,10-12,15,17H2,1-2H3,(H,26,28)/t18-,20-/m0/s1