(2-ethanoyl-4-fluoranyl-phenyl) 2,5-dimethylbenzenesulfonate

Systemtic Name: (2-ethanoyl-4-fluoranyl-phenyl) 2,5-dimethylbenzenesulfonate Openeye Name: (2-acetyl-4-fluoro-phenyl) 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid (2-acetyl-4-fluorophenyl) ester IUPAC Name: (2-acetyl-4-fluorophenyl) 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid (2-acetyl-4-fluoro-phenyl) ester Formula: C16H15FO4S MolecularWeight: 322.351303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=C(C=C(C=C2)F)C(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=C(C=C(C=C2)F)C(=O)C

InChI

InChI=1S/C16H15FO4S/c1-10-4-5-11(2)16(8-10)22(19,20)21-15-7-6-13(17)9-14(15)12(3)18/h4-9H,1-3H3