3-ethylsulfonyl-4,5-dimethyl-benzoic acid

Systemtic Name: 3-ethylsulfonyl-4,5-dimethyl-benzoic acid Openeye Name: 3-ethylsulfonyl-4,5-dimethyl-benzoic acid CAS Name: 3-ethylsulfonyl-4,5-dimethylbenzoic acid IUPAC Name: 3-ethylsulfonyl-4,5-dimethylbenzoic acid Traditional Name: 3-esyl-4,5-dimethyl-benzoic acid Formula: C11H14O4S MolecularWeight: 242.29146

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=CC(=C1C)C)C(=O)O

Isomeric SMILES

CCS(=O)(=O)C1=CC(=CC(=C1C)C)C(=O)O

InChI

InChI=1S/C11H14O4S/c1-4-16(14,15)10-6-9(11(12)13)5-7(2)8(10)3/h5-6H,4H2,1-3H3,(H,12,13)