(3-ethanoylphenyl) 3-chloranyl-4-fluoranyl-benzenesulfonate

Systemtic Name: (3-ethanoylphenyl) 3-chloranyl-4-fluoranyl-benzenesulfonate Openeye Name: (3-acetylphenyl) 3-chloro-4-fluoro-benzenesulfonate CAS Name: 3-chloro-4-fluorobenzenesulfonic acid (3-acetylphenyl) ester IUPAC Name: (3-acetylphenyl) 3-chloro-4-fluorobenzenesulfonate Traditional Name: 3-chloro-4-fluoro-benzenesulfonic acid (3-acetylphenyl) ester Formula: C14H10ClFO4S MolecularWeight: 328.743203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OS(=O)(=O)C2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OS(=O)(=O)C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C14H10ClFO4S/c1-9(17)10-3-2-4-11(7-10)20-21(18,19)12-5-6-14(16)13(15)8-12/h2-8H,1H3