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

Systemtic Name: (3R)-1-(4-acetamidophenyl)sulfonyl-N-[(1S)-2-oxidanyl-1-phenyl-ethyl]piperidine-3-carboxamide Openeye Name: (3R)-1-(4-acetamidophenyl)sulfonyl-N-[(1S)-2-hydroxy-1-phenyl-ethyl]piperidine-3-carboxamide CAS Name: (3R)-1-(4-acetamidophenyl)sulfonyl-N-[(1S)-2-hydroxy-1-phenylethyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-(4-acetamidophenyl)sulfonyl-N-[(1S)-2-hydroxy-1-phenylethyl]piperidine-3-carboxamide Traditional Name: (3R)-1-(4-acetamidophenyl)sulfonyl-N-[(1S)-2-hydroxy-1-phenyl-ethyl]nipecotamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC(CO)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)N[C@H](CO)C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O5S/c1-16(27)23-19-9-11-20(12-10-19)31(29,30)25-13-5-8-18(14-25)22(28)24-21(15-26)17-6-3-2-4-7-17/h2-4,6-7,9-12,18,21,26H,5,8,13-15H2,1H3,(H,23,27)(H,24,28)/t18-,21-/m1/s1