2-methyl-4-phenyl-6-(trifluoromethylsulfonyloxy)benzoic acid

Systemtic Name: 2-methyl-4-phenyl-6-(trifluoromethylsulfonyloxy)benzoic acid Openeye Name: 2-methyl-4-phenyl-6-(trifluoromethylsulfonyloxy)benzoic acid CAS Name: 2-methyl-4-phenyl-6-(trifluoromethylsulfonyloxy)benzoic acid IUPAC Name: 2-methyl-4-phenyl-6-(trifluoromethylsulfonyloxy)benzoic acid Traditional Name: 2-methyl-4-phenyl-6-triflyloxy-benzoic acid Formula: C15H11F3O5S MolecularWeight: 360.30505

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C2=CC=CC=C2)OS(=O)(=O)C(F)(F)F)C(=O)O

Isomeric SMILES

CC1=C(C(=CC(=C1)C2=CC=CC=C2)OS(=O)(=O)C(F)(F)F)C(=O)O

InChI

InChI=1S/C15H11F3O5S/c1-9-7-11(10-5-3-2-4-6-10)8-12(13(9)14(19)20)23-24(21,22)15(16,17)18/h2-8H,1H3,(H,19,20)