3-methoxy-4-methylsulfonyloxy-benzoic acid

Systemtic Name: 3-methoxy-4-methylsulfonyloxy-benzoic acid Openeye Name: 3-methoxy-4-methylsulfonyloxy-benzoic acid CAS Name: 3-methoxy-4-methylsulfonyloxybenzoic acid IUPAC Name: 3-methoxy-4-methylsulfonyloxybenzoic acid Traditional Name: 3-methoxy-4-methylsulfonyloxy-benzoic acid Formula: C9H10O6S MolecularWeight: 246.2371

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)O)OS(=O)(=O)C

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)O)OS(=O)(=O)C

InChI

InChI=1S/C9H10O6S/c1-14-8-5-6(9(10)11)3-4-7(8)15-16(2,12)13/h3-5H,1-2H3,(H,10,11)