tert-butyl 4-[(2S)-1,2-bis(oxidanyl)-3-(phenylmethylsulfanyl)propan-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(2S)-1,2-bis(oxidanyl)-3-(phenylmethylsulfanyl)propan-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(1S)-1-(benzylsulfanylmethyl)-1,2-dihydroxy-ethyl]piperidine-1-carboxylate CAS Name: 4-[(2S)-1,2-dihydroxy-3-(phenylmethylthio)propan-2-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2S)-1-benzylsulfanyl-2,3-dihydroxypropan-2-yl]piperidine-1-carboxylate Traditional Name: 4-[(1S)-1-[(benzylthio)methyl]-1,2-dihydroxy-ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H31NO4S MolecularWeight: 381.52944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(CO)(CSCC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)[C@](CO)(CSCC2=CC=CC=C2)O

InChI

InChI=1S/C20H31NO4S/c1-19(2,3)25-18(23)21-11-9-17(10-12-21)20(24,14-22)15-26-13-16-7-5-4-6-8-16/h4-8,17,22,24H,9-15H2,1-3H3/t20-/m0/s1