2-(methylsulfonylmethyl)-4-(trifluoromethyl)benzoic acid

Systemtic Name: 2-(methylsulfonylmethyl)-4-(trifluoromethyl)benzoic acid Openeye Name: 2-(methylsulfonylmethyl)-4-(trifluoromethyl)benzoic acid CAS Name: 2-(methylsulfonylmethyl)-4-(trifluoromethyl)benzoic acid IUPAC Name: 2-(methylsulfonylmethyl)-4-(trifluoromethyl)benzoic acid Traditional Name: 2-(mesylmethyl)-4-(trifluoromethyl)benzoic acid Formula: C10H9F3O4S MolecularWeight: 282.23627

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=C(C=CC(=C1)C(F)(F)F)C(=O)O

Isomeric SMILES

CS(=O)(=O)CC1=C(C=CC(=C1)C(F)(F)F)C(=O)O

InChI

InChI=1S/C10H9F3O4S/c1-18(16,17)5-6-4-7(10(11,12)13)2-3-8(6)9(14)15/h2-4H,5H2,1H3,(H,14,15)