1-[3-[(3-chlorophenyl)methyl]-3-(hydroxymethyl)piperidin-1-yl]-2-methylsulfanyl-ethanone

Systemtic Name: 1-[3-[(3-chlorophenyl)methyl]-3-(hydroxymethyl)piperidin-1-yl]-2-methylsulfanyl-ethanone Openeye Name: 1-[3-[(3-chlorophenyl)methyl]-3-(hydroxymethyl)-1-piperidyl]-2-methylsulfanyl-ethanone CAS Name: 1-[3-[(3-chlorophenyl)methyl]-3-(hydroxymethyl)-1-piperidinyl]-2-(methylthio)ethanone IUPAC Name: 1-[3-[(3-chlorophenyl)methyl]-3-(hydroxymethyl)piperidin-1-yl]-2-methylsulfanylethanone Traditional Name: 1-[3-(3-chlorobenzyl)-3-methylol-piperidino]-2-(methylthio)ethanone Formula: C16H22ClNO2S MolecularWeight: 327.86938

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(=O)N1CCCC(C1)(CC2=CC(=CC=C2)Cl)CO

Isomeric SMILES

CSCC(=O)N1CCCC(C1)(CC2=CC(=CC=C2)Cl)CO

InChI

InChI=1S/C16H22ClNO2S/c1-21-10-15(20)18-7-3-6-16(11-18,12-19)9-13-4-2-5-14(17)8-13/h2,4-5,8,19H,3,6-7,9-12H2,1H3