1-(4-methylsulfonylphenyl)propane-1,3-diol

Systemtic Name: 1-(4-methylsulfonylphenyl)propane-1,3-diol Openeye Name: 1-(4-methylsulfonylphenyl)propane-1,3-diol CAS Name: 1-(4-methylsulfonylphenyl)propane-1,3-diol IUPAC Name: 1-(4-methylsulfonylphenyl)propane-1,3-diol Traditional Name: 1-(4-mesylphenyl)propane-1,3-diol Formula: C10H14O4S MolecularWeight: 230.28076

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(CCO)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(CCO)O

InChI

InChI=1S/C10H14O4S/c1-15(13,14)9-4-2-8(3-5-9)10(12)6-7-11/h2-5,10-12H,6-7H2,1H3