2-methyl-4-(trifluoromethyl)benzenesulfonic acid

Systemtic Name: 2-methyl-4-(trifluoromethyl)benzenesulfonic acid Openeye Name: 2-methyl-4-(trifluoromethyl)benzenesulfonic acid CAS Name: 2-methyl-4-(trifluoromethyl)benzenesulfonic acid IUPAC Name: 2-methyl-4-(trifluoromethyl)benzenesulfonic acid Traditional Name: 2-methyl-4-(trifluoromethyl)besylic acid Formula: C8H7F3O3S MolecularWeight: 240.19959

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H7F3O3S/c1-5-4-6(8(9,10)11)2-3-7(5)15(12,13)14/h2-4H,1H3,(H,12,13,14)