sodium 2-ethylsulfanyl-6-fluoranyl-benzenesulfonate

Systemtic Name: sodium 2-ethylsulfanyl-6-fluoranyl-benzenesulfonate Openeye Name: sodium 2-ethylsulfanyl-6-fluoro-benzenesulfonate CAS Name: sodium 2-(ethylthio)-6-fluorobenzenesulfonate IUPAC Name: sodium 2-ethylsulfanyl-6-fluorobenzenesulfonate Traditional Name: sodium 2-(ethylthio)-6-fluoro-besylate Formula: C8H8FNaO3S2 MolecularWeight: 258.265493

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC(=C1S(=O)(=O)[O-])F.[Na+]

Isomeric SMILES

CCSC1=CC=CC(=C1S(=O)(=O)[O-])F.[Na+]

InChI

InChI=1S/C8H9FO3S2.Na/c1-2-13-7-5-3-4-6(9)8(7)14(10,11)12;/h3-5H,2H2,1H3,(H,10,11,12);/q;+1/p-1