(1S,2S,3S,4R)-3-phenylsulfanylcyclohexane-1,2,4-triol

Systemtic Name: (1S,2S,3S,4R)-3-phenylsulfanylcyclohexane-1,2,4-triol Openeye Name: (1S,2S,3S,4R)-3-phenylsulfanylcyclohexane-1,2,4-triol CAS Name: (1S,2S,3S,4R)-3-(phenylthio)cyclohexane-1,2,4-triol IUPAC Name: (1S,2S,3S,4R)-3-phenylsulfanylcyclohexane-1,2,4-triol Traditional Name: (1S,2S,3S,4R)-3-(phenylthio)cyclohexane-1,2,4-triol Formula: C12H16O3S MolecularWeight: 240.31864

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C(C1O)O)SC2=CC=CC=C2)O

Isomeric SMILES

C1C[C@H]([C@@H]([C@H]([C@H]1O)O)SC2=CC=CC=C2)O

InChI

InChI=1S/C12H16O3S/c13-9-6-7-10(14)12(11(9)15)16-8-4-2-1-3-5-8/h1-5,9-15H,6-7H2/t9-,10+,11-,12-/m0/s1