[2-(3-fluorophenyl)-2-oxidanylidene-ethyl] 4-(methylsulfonylmethyl)benzoate

Systemtic Name: [2-(3-fluorophenyl)-2-oxidanylidene-ethyl] 4-(methylsulfonylmethyl)benzoate Openeye Name: [2-(3-fluorophenyl)-2-oxo-ethyl] 4-(methylsulfonylmethyl)benzoate CAS Name: 4-(methylsulfonylmethyl)benzoic acid [2-(3-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-fluorophenyl)-2-oxoethyl] 4-(methylsulfonylmethyl)benzoate Traditional Name: 4-(mesylmethyl)benzoic acid [2-(3-fluorophenyl)-2-keto-ethyl] ester Formula: C17H15FO5S MolecularWeight: 350.361403

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC(=CC=C2)F

Isomeric SMILES

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC(=CC=C2)F

InChI

InChI=1S/C17H15FO5S/c1-24(21,22)11-12-5-7-13(8-6-12)17(20)23-10-16(19)14-3-2-4-15(18)9-14/h2-9H,10-11H2,1H3