2-methoxy-5-(2-methylpropylsulfonyl)benzoic acid

Systemtic Name: 2-methoxy-5-(2-methylpropylsulfonyl)benzoic acid Openeye Name: 5-isobutylsulfonyl-2-methoxy-benzoic acid CAS Name: 2-methoxy-5-(2-methylpropylsulfonyl)benzoic acid IUPAC Name: 2-methoxy-5-(2-methylpropylsulfonyl)benzoic acid Traditional Name: 5-isobutylsulfonyl-2-methoxy-benzoic acid Formula: C12H16O5S MolecularWeight: 272.31744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16O5S/c1-8(2)7-18(15,16)9-4-5-11(17-3)10(6-9)12(13)14/h4-6,8H,7H2,1-3H3,(H,13,14)