(2-ethanoyl-4-methyl-phenyl) 4-chloranyl-2-fluoranyl-benzenesulfonate

Systemtic Name: (2-ethanoyl-4-methyl-phenyl) 4-chloranyl-2-fluoranyl-benzenesulfonate Openeye Name: (2-acetyl-4-methyl-phenyl) 4-chloro-2-fluoro-benzenesulfonate CAS Name: 4-chloro-2-fluorobenzenesulfonic acid (2-acetyl-4-methylphenyl) ester IUPAC Name: (2-acetyl-4-methylphenyl) 4-chloro-2-fluorobenzenesulfonate Traditional Name: 4-chloro-2-fluoro-benzenesulfonic acid (2-acetyl-4-methyl-phenyl) ester Formula: C15H12ClFO4S MolecularWeight: 342.769783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OS(=O)(=O)C2=C(C=C(C=C2)Cl)F)C(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)OS(=O)(=O)C2=C(C=C(C=C2)Cl)F)C(=O)C

InChI

InChI=1S/C15H12ClFO4S/c1-9-3-5-14(12(7-9)10(2)18)21-22(19,20)15-6-4-11(16)8-13(15)17/h3-8H,1-2H3