2-methoxy-4-methylsulfonyl-benzoic acid

Systemtic Name: 2-methoxy-4-methylsulfonyl-benzoic acid Openeye Name: 2-methoxy-4-methylsulfonyl-benzoic acid CAS Name: 2-methoxy-4-methylsulfonylbenzoic acid IUPAC Name: 2-methoxy-4-methylsulfonylbenzoic acid Traditional Name: 4-mesyl-2-methoxy-benzoic acid Formula: C9H10O5S MolecularWeight: 230.2377

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10O5S/c1-14-8-5-6(15(2,12)13)3-4-7(8)9(10)11/h3-5H,1-2H3,(H,10,11)