2-ethylsulfanyl-6-fluoranyl-benzenesulfonic acid

Systemtic Name: 2-ethylsulfanyl-6-fluoranyl-benzenesulfonic acid Openeye Name: 2-ethylsulfanyl-6-fluoro-benzenesulfonic acid CAS Name: 2-(ethylthio)-6-fluorobenzenesulfonic acid IUPAC Name: 2-ethylsulfanyl-6-fluorobenzenesulfonic acid Traditional Name: 2-(ethylthio)-6-fluoro-besylic acid Formula: C8H9FO3S2 MolecularWeight: 236.283663

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC(=C1S(=O)(=O)O)F

Isomeric SMILES

CCSC1=CC=CC(=C1S(=O)(=O)O)F

InChI

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