sodium 2-fluoranyl-6-(trifluoromethyloxy)benzenesulfonate

Systemtic Name: sodium 2-fluoranyl-6-(trifluoromethyloxy)benzenesulfonate Openeye Name: sodium 2-fluoro-6-(trifluoromethoxy)benzenesulfonate CAS Name: sodium 2-fluoro-6-(trifluoromethoxy)benzenesulfonate IUPAC Name: sodium 2-fluoro-6-(trifluoromethoxy)benzenesulfonate Traditional Name: sodium 2-fluoro-6-(trifluoromethoxy)besylate Formula: C7H3F4NaO4S MolecularWeight: 282.144703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)S(=O)(=O)[O-])OC(F)(F)F.[Na+]

Isomeric SMILES

C1=CC(=C(C(=C1)F)S(=O)(=O)[O-])OC(F)(F)F.[Na+]

InChI

InChI=1S/C7H4F4O4S.Na/c8-4-2-1-3-5(15-7(9,10)11)6(4)16(12,13)14;/h1-3H,(H,12,13,14);/q;+1/p-1