1-[3-(hydroxymethyl)piperidin-1-yl]-2-(phenylmethylsulfanyl)ethanone

Systemtic Name: 1-[3-(hydroxymethyl)piperidin-1-yl]-2-(phenylmethylsulfanyl)ethanone Openeye Name: 2-benzylsulfanyl-1-[3-(hydroxymethyl)-1-piperidyl]ethanone CAS Name: 1-[3-(hydroxymethyl)-1-piperidinyl]-2-(phenylmethylthio)ethanone IUPAC Name: 2-benzylsulfanyl-1-[3-(hydroxymethyl)piperidin-1-yl]ethanone Traditional Name: 2-(benzylthio)-1-(3-methylolpiperidino)ethanone Formula: C15H21NO2S MolecularWeight: 279.39774

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSCC2=CC=CC=C2)CO

Isomeric SMILES

C1CC(CN(C1)C(=O)CSCC2=CC=CC=C2)CO

InChI

InChI=1S/C15H21NO2S/c17-10-14-7-4-8-16(9-14)15(18)12-19-11-13-5-2-1-3-6-13/h1-3,5-6,14,17H,4,7-12H2