5-(2-ethylsulfonylethylsulfonyl)-2-methyl-benzoic acid

Systemtic Name: 5-(2-ethylsulfonylethylsulfonyl)-2-methyl-benzoic acid Openeye Name: 5-(2-ethylsulfonylethylsulfonyl)-2-methyl-benzoic acid CAS Name: 5-(2-ethylsulfonylethylsulfonyl)-2-methylbenzoic acid IUPAC Name: 5-(2-ethylsulfonylethylsulfonyl)-2-methylbenzoic acid Traditional Name: 5-(2-esylethylsulfonyl)-2-methyl-benzoic acid Formula: C12H16O6S2 MolecularWeight: 320.38184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16O6S2/c1-3-19(15,16)6-7-20(17,18)10-5-4-9(2)11(8-10)12(13)14/h4-5,8H,3,6-7H2,1-2H3,(H,13,14)