tert-butyl 2-methyl-4-(3-methylsulfanylphenyl)-4-oxidanyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 2-methyl-4-(3-methylsulfanylphenyl)-4-oxidanyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-hydroxy-2-methyl-4-(3-methylsulfanylphenyl)piperidine-1-carboxylate CAS Name: 4-hydroxy-2-methyl-4-[3-(methylthio)phenyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-hydroxy-2-methyl-4-(3-methylsulfanylphenyl)piperidine-1-carboxylate Traditional Name: 4-hydroxy-2-methyl-4-[3-(methylthio)phenyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C18H27NO3S MolecularWeight: 337.47688

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CCN1C(=O)OC(C)(C)C)(C2=CC(=CC=C2)SC)O

Isomeric SMILES

CC1CC(CCN1C(=O)OC(C)(C)C)(C2=CC(=CC=C2)SC)O

InChI

InChI=1S/C18H27NO3S/c1-13-12-18(21,14-7-6-8-15(11-14)23-5)9-10-19(13)16(20)22-17(2,3)4/h6-8,11,13,21H,9-10,12H2,1-5H3