tert-butyl (2S,6R)-2-methyl-6-(phenylsulfanylmethyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl (2S,6R)-2-methyl-6-(phenylsulfanylmethyl)piperidine-1-carboxylate Openeye Name: tert-butyl (2S,6R)-2-methyl-6-(phenylsulfanylmethyl)piperidine-1-carboxylate CAS Name: (2S,6R)-2-methyl-6-[(phenylthio)methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,6R)-2-methyl-6-(phenylsulfanylmethyl)piperidine-1-carboxylate Traditional Name: (2S,6R)-2-methyl-6-[(phenylthio)methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C18H27NO2S MolecularWeight: 321.47748

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)OC(C)(C)C)CSC2=CC=CC=C2

Isomeric SMILES

C[C@H]1CCC[C@@H](N1C(=O)OC(C)(C)C)CSC2=CC=CC=C2

InChI

InChI=1S/C18H27NO2S/c1-14-9-8-10-15(13-22-16-11-6-5-7-12-16)19(14)17(20)21-18(2,3)4/h5-7,11-12,14-15H,8-10,13H2,1-4H3/t14-,15+/m0/s1