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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(C2=CC=CC=C2SC)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(C2=CC=CC=C2SC)O

InChI

InChI=1S/C18H27NO3S/c1-18(2,3)22-17(21)19-11-9-13(10-12-19)16(20)14-7-5-6-8-15(14)23-4/h5-8,13,16,20H,9-12H2,1-4H3