2-methyl-5-methylsulfonyl-4-(trifluoromethyloxy)benzoic acid

Systemtic Name: 2-methyl-5-methylsulfonyl-4-(trifluoromethyloxy)benzoic acid Openeye Name: 2-methyl-5-methylsulfonyl-4-(trifluoromethoxy)benzoic acid CAS Name: 2-methyl-5-methylsulfonyl-4-(trifluoromethoxy)benzoic acid IUPAC Name: 2-methyl-5-methylsulfonyl-4-(trifluoromethoxy)benzoic acid Traditional Name: 5-mesyl-2-methyl-4-(trifluoromethoxy)benzoic acid Formula: C10H9F3O5S MolecularWeight: 298.23567

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)OC(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)OC(F)(F)F

InChI

InChI=1S/C10H9F3O5S/c1-5-3-7(18-10(11,12)13)8(19(2,16)17)4-6(5)9(14)15/h3-4H,1-2H3,(H,14,15)