(3S)-1-(4-methoxyphenyl)sulfonyl-N-[(2S)-2-oxidanyl-2-phenyl-ethyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-[(2S)-2-oxidanyl-2-phenyl-ethyl]piperidine-3-carboxamide Openeye Name: (3S)-N-[(2S)-2-hydroxy-2-phenyl-ethyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-[(2S)-2-hydroxy-2-phenylethyl]-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-[(2S)-2-hydroxy-2-phenylethyl]-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-[(2S)-2-hydroxy-2-phenyl-ethyl]-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O5S/c1-28-18-9-11-19(12-10-18)29(26,27)23-13-5-8-17(15-23)21(25)22-14-20(24)16-6-3-2-4-7-16/h2-4,6-7,9-12,17,20,24H,5,8,13-15H2,1H3,(H,22,25)/t17-,20+/m0/s1