1-[4-[2-(2-methylbutan-2-ylsulfanylmethyl)phenyl]-4-oxidanyl-piperidin-1-yl]ethanone

Systemtic Name: 1-[4-[2-(2-methylbutan-2-ylsulfanylmethyl)phenyl]-4-oxidanyl-piperidin-1-yl]ethanone Openeye Name: 1-[4-[2-(1,1-dimethylpropylsulfanylmethyl)phenyl]-4-hydroxy-1-piperidyl]ethanone CAS Name: 1-[4-hydroxy-4-[2-[(2-methylbutan-2-ylthio)methyl]phenyl]-1-piperidinyl]ethanone IUPAC Name: 1-[4-hydroxy-4-[2-(2-methylbutan-2-ylsulfanylmethyl)phenyl]piperidin-1-yl]ethanone Traditional Name: 1-[4-[2-[(tert-amylthio)methyl]phenyl]-4-hydroxy-piperidino]ethanone Formula: C19H29NO2S MolecularWeight: 335.50406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)SCC1=CC=CC=C1C2(CCN(CC2)C(=O)C)O

Isomeric SMILES

CCC(C)(C)SCC1=CC=CC=C1C2(CCN(CC2)C(=O)C)O

InChI

InChI=1S/C19H29NO2S/c1-5-18(3,4)23-14-16-8-6-7-9-17(16)19(22)10-12-20(13-11-19)15(2)21/h6-9,22H,5,10-14H2,1-4H3