3-methyl-2-(trifluoromethylsulfonyloxy)benzoate

Systemtic Name: 3-methyl-2-(trifluoromethylsulfonyloxy)benzoate Openeye Name: 3-methyl-2-(trifluoromethylsulfonyloxy)benzoate CAS Name: 3-methyl-2-(trifluoromethylsulfonyloxy)benzoate IUPAC Name: 3-methyl-2-(trifluoromethylsulfonyloxy)benzoate Traditional Name: 3-methyl-2-triflyloxy-benzoate Formula: C9H6F3O5S- MolecularWeight: 283.20115

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OS(=O)(=O)C(F)(F)F)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1OS(=O)(=O)C(F)(F)F)C(=O)[O-]

InChI

InChI=1S/C9H7F3O5S/c1-5-3-2-4-6(8(13)14)7(5)17-18(15,16)9(10,11)12/h2-4H,1H3,(H,13,14)/p-1