2,3-dimethoxy-5-[2,2,2-tris(fluoranyl)ethylsulfonyl]benzoic acid

Systemtic Name: 2,3-dimethoxy-5-[2,2,2-tris(fluoranyl)ethylsulfonyl]benzoic acid Openeye Name: 2,3-dimethoxy-5-(2,2,2-trifluoroethylsulfonyl)benzoic acid CAS Name: 2,3-dimethoxy-5-(2,2,2-trifluoroethylsulfonyl)benzoic acid IUPAC Name: 2,3-dimethoxy-5-(2,2,2-trifluoroethylsulfonyl)benzoic acid Traditional Name: 2,3-dimethoxy-5-(2,2,2-trifluoroethylsulfonyl)benzoic acid Formula: C11H11F3O6S MolecularWeight: 328.26165

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)S(=O)(=O)CC(F)(F)F)C(=O)O)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)S(=O)(=O)CC(F)(F)F)C(=O)O)OC

InChI

InChI=1S/C11H11F3O6S/c1-19-8-4-6(21(17,18)5-11(12,13)14)3-7(10(15)16)9(8)20-2/h3-4H,5H2,1-2H3,(H,15,16)