sodium (E)-2-[4-(trifluoromethylsulfonyloxy)phenyl]ethenesulfonate

Systemtic Name: sodium (E)-2-[4-(trifluoromethylsulfonyloxy)phenyl]ethenesulfonate Openeye Name: sodium (E)-2-[4-(trifluoromethylsulfonyloxy)phenyl]ethenesulfonate CAS Name: sodium (E)-2-[4-(trifluoromethylsulfonyloxy)phenyl]ethenesulfonate IUPAC Name: sodium (E)-2-[4-(trifluoromethylsulfonyloxy)phenyl]ethenesulfonate Traditional Name: sodium (E)-2-(4-triflyloxyphenyl)ethenesulfonate Formula: C9H6F3NaO6S2 MolecularWeight: 354.25532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CS(=O)(=O)[O-])OS(=O)(=O)C(F)(F)F.[Na+]

Isomeric SMILES

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

InChI

InChI=1S/C9H7F3O6S2.Na/c10-9(11,12)20(16,17)18-8-3-1-7(2-4-8)5-6-19(13,14)15;/h1-6H,(H,13,14,15);/q;+1/p-1/b6-5+;