methyl 3-methylsulfonyl-4-oxidanyl-benzoate

Systemtic Name: methyl 3-methylsulfonyl-4-oxidanyl-benzoate Openeye Name: methyl 4-hydroxy-3-methylsulfonyl-benzoate CAS Name: 4-hydroxy-3-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-hydroxy-3-methylsulfonylbenzoate Traditional Name: 4-hydroxy-3-mesyl-benzoic acid methyl ester Formula: C9H10O5S MolecularWeight: 230.2377

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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