3-(4-methoxy-3-methylsulfonyloxy-phenyl)-3-methyl-butanoic acid

Systemtic Name: 3-(4-methoxy-3-methylsulfonyloxy-phenyl)-3-methyl-butanoic acid Openeye Name: 3-(4-methoxy-3-methylsulfonyloxy-phenyl)-3-methyl-butanoic acid CAS Name: 3-(4-methoxy-3-methylsulfonyloxyphenyl)-3-methylbutanoic acid IUPAC Name: 3-(4-methoxy-3-methylsulfonyloxyphenyl)-3-methylbutanoic acid Traditional Name: 3-(4-methoxy-3-methylsulfonyloxy-phenyl)-3-methyl-butyric acid Formula: C13H18O6S MolecularWeight: 302.34342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)O)C1=CC(=C(C=C1)OC)OS(=O)(=O)C

Isomeric SMILES

CC(C)(CC(=O)O)C1=CC(=C(C=C1)OC)OS(=O)(=O)C

InChI

InChI=1S/C13H18O6S/c1-13(2,8-12(14)15)9-5-6-10(18-3)11(7-9)19-20(4,16)17/h5-7H,8H2,1-4H3,(H,14,15)