3-[(E)-2-methylsulfonyl-3-phenyl-prop-2-enyl]sulfanylpropane-1,2-diol

Systemtic Name: 3-[(E)-2-methylsulfonyl-3-phenyl-prop-2-enyl]sulfanylpropane-1,2-diol Openeye Name: 3-[(E)-2-methylsulfonyl-3-phenyl-allyl]sulfanylpropane-1,2-diol CAS Name: 3-[[(E)-2-methylsulfonyl-3-phenylprop-2-enyl]thio]propane-1,2-diol IUPAC Name: 3-[(E)-2-methylsulfonyl-3-phenylprop-2-enyl]sulfanylpropane-1,2-diol Traditional Name: 3-[[(E)-2-mesyl-3-phenyl-allyl]thio]propane-1,2-diol Formula: C13H18O4S2 MolecularWeight: 302.40962

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C(=CC1=CC=CC=C1)CSCC(CO)O

Isomeric SMILES

CS(=O)(=O)/C(=C/C1=CC=CC=C1)/CSCC(CO)O

InChI

InChI=1S/C13H18O4S2/c1-19(16,17)13(10-18-9-12(15)8-14)7-11-5-3-2-4-6-11/h2-7,12,14-15H,8-10H2,1H3/b13-7+