2-methyl-3-(phenylsulfanylmethyl)octane-2,3-diol

Systemtic Name: 2-methyl-3-(phenylsulfanylmethyl)octane-2,3-diol Openeye Name: 2-methyl-3-(phenylsulfanylmethyl)octane-2,3-diol CAS Name: 2-methyl-3-[(phenylthio)methyl]octane-2,3-diol IUPAC Name: 2-methyl-3-(phenylsulfanylmethyl)octane-2,3-diol Traditional Name: 2-methyl-3-[(phenylthio)methyl]octane-2,3-diol Formula: C16H26O2S MolecularWeight: 282.44144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CSC1=CC=CC=C1)(C(C)(C)O)O

Isomeric SMILES

CCCCCC(CSC1=CC=CC=C1)(C(C)(C)O)O

InChI

InChI=1S/C16H26O2S/c1-4-5-9-12-16(18,15(2,3)17)13-19-14-10-7-6-8-11-14/h6-8,10-11,17-18H,4-5,9,12-13H2,1-3H3