ethyl 3-methyl-4-methylsulfonyl-2-oxidanyl-benzoate

Systemtic Name: ethyl 3-methyl-4-methylsulfonyl-2-oxidanyl-benzoate Openeye Name: ethyl 2-hydroxy-3-methyl-4-methylsulfonyl-benzoate CAS Name: 2-hydroxy-3-methyl-4-methylsulfonylbenzoic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-3-methyl-4-methylsulfonylbenzoate Traditional Name: 2-hydroxy-4-mesyl-3-methyl-benzoic acid ethyl ester Formula: C11H14O5S MolecularWeight: 258.29086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C=C1)S(=O)(=O)C)C)O

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C=C1)S(=O)(=O)C)C)O

InChI

InChI=1S/C11H14O5S/c1-4-16-11(13)8-5-6-9(17(3,14)15)7(2)10(8)12/h5-6,12H,4H2,1-3H3