3-methoxy-4-(trifluoromethylsulfonyloxy)benzoic acid

Systemtic Name: 3-methoxy-4-(trifluoromethylsulfonyloxy)benzoic acid Openeye Name: 3-methoxy-4-(trifluoromethylsulfonyloxy)benzoic acid CAS Name: 3-methoxy-4-(trifluoromethylsulfonyloxy)benzoic acid IUPAC Name: 3-methoxy-4-(trifluoromethylsulfonyloxy)benzoic acid Traditional Name: 3-methoxy-4-triflyloxy-benzoic acid Formula: C9H7F3O6S MolecularWeight: 300.20849

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)O)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)O)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C9H7F3O6S/c1-17-7-4-5(8(13)14)2-3-6(7)18-19(15,16)9(10,11)12/h2-4H,1H3,(H,13,14)