methyl 2,4-dimethyl-3-methylsulfonyl-benzoate

Systemtic Name: methyl 2,4-dimethyl-3-methylsulfonyl-benzoate Openeye Name: methyl 2,4-dimethyl-3-methylsulfonyl-benzoate CAS Name: 2,4-dimethyl-3-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-3-methylsulfonylbenzoate Traditional Name: 3-mesyl-2,4-dimethyl-benzoic acid methyl ester Formula: C11H14O4S MolecularWeight: 242.29146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)OC)C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)OC)C)S(=O)(=O)C

InChI

InChI=1S/C11H14O4S/c1-7-5-6-9(11(12)15-3)8(2)10(7)16(4,13)14/h5-6H,1-4H3