(2-ethanoyl-5-methyl-phenyl) 3-fluoranylbenzenesulfonate

Systemtic Name: (2-ethanoyl-5-methyl-phenyl) 3-fluoranylbenzenesulfonate Openeye Name: (2-acetyl-5-methyl-phenyl) 3-fluorobenzenesulfonate CAS Name: 3-fluorobenzenesulfonic acid (2-acetyl-5-methylphenyl) ester IUPAC Name: (2-acetyl-5-methylphenyl) 3-fluorobenzenesulfonate Traditional Name: 3-fluorobenzenesulfonic acid (2-acetyl-5-methyl-phenyl) ester Formula: C15H13FO4S MolecularWeight: 308.324723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13FO4S/c1-10-6-7-14(11(2)17)15(8-10)20-21(18,19)13-5-3-4-12(16)9-13/h3-9H,1-2H3