2,3-dimethoxy-5-(2-methylpropylsulfonyl)benzoic acid

Systemtic Name: 2,3-dimethoxy-5-(2-methylpropylsulfonyl)benzoic acid Openeye Name: 5-isobutylsulfonyl-2,3-dimethoxy-benzoic acid CAS Name: 2,3-dimethoxy-5-(2-methylpropylsulfonyl)benzoic acid IUPAC Name: 2,3-dimethoxy-5-(2-methylpropylsulfonyl)benzoic acid Traditional Name: 5-isobutylsulfonyl-2,3-dimethoxy-benzoic acid Formula: C13H18O6S MolecularWeight: 302.34342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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