2-chloranyl-6-ethyl-4-fluoranyl-benzenesulfonic acid

Systemtic Name: 2-chloranyl-6-ethyl-4-fluoranyl-benzenesulfonic acid Openeye Name: 2-chloro-6-ethyl-4-fluoro-benzenesulfonic acid CAS Name: 2-chloro-6-ethyl-4-fluorobenzenesulfonic acid IUPAC Name: 2-chloro-6-ethyl-4-fluorobenzenesulfonic acid Traditional Name: 2-chloro-6-ethyl-4-fluoro-besylic acid Formula: C8H8ClFO3S MolecularWeight: 238.663723

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1S(=O)(=O)O)Cl)F

Isomeric SMILES

CCC1=CC(=CC(=C1S(=O)(=O)O)Cl)F

InChI

InChI=1S/C8H8ClFO3S/c1-2-5-3-6(10)4-7(9)8(5)14(11,12)13/h3-4H,2H2,1H3,(H,11,12,13)