tert-butyl (2R)-2-(phenylsulfanylmethyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl (2R)-2-(phenylsulfanylmethyl)piperidine-1-carboxylate Openeye Name: tert-butyl (2R)-2-(phenylsulfanylmethyl)piperidine-1-carboxylate CAS Name: (2R)-2-[(phenylthio)methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-(phenylsulfanylmethyl)piperidine-1-carboxylate Traditional Name: (2R)-2-[(phenylthio)methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C17H25NO2S MolecularWeight: 307.4509

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCC1CSC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC[C@@H]1CSC2=CC=CC=C2

InChI

InChI=1S/C17H25NO2S/c1-17(2,3)20-16(19)18-12-8-7-9-14(18)13-21-15-10-5-4-6-11-15/h4-6,10-11,14H,7-9,12-13H2,1-3H3/t14-/m1/s1