(3R,4S)-2,2-dimethyl-4-phenylsulfanyl-heptane-1,3-diol

Systemtic Name: (3R,4S)-2,2-dimethyl-4-phenylsulfanyl-heptane-1,3-diol Openeye Name: (3R,4S)-2,2-dimethyl-4-phenylsulfanyl-heptane-1,3-diol CAS Name: (3R,4S)-2,2-dimethyl-4-(phenylthio)heptane-1,3-diol IUPAC Name: (3R,4S)-2,2-dimethyl-4-phenylsulfanylheptane-1,3-diol Traditional Name: (3R,4S)-2,2-dimethyl-4-(phenylthio)heptane-1,3-diol Formula: C15H24O2S MolecularWeight: 268.41486

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C(C)(C)CO)O)SC1=CC=CC=C1

Isomeric SMILES

CCC[C@@H]([C@@H](C(C)(C)CO)O)SC1=CC=CC=C1

InChI

InChI=1S/C15H24O2S/c1-4-8-13(14(17)15(2,3)11-16)18-12-9-6-5-7-10-12/h5-7,9-10,13-14,16-17H,4,8,11H2,1-3H3/t13-,14-/m0/s1