[2-[2,5-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 4-methylsulfonylbenzoate

Systemtic Name: [2-[2,5-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 4-methylsulfonylbenzoate Openeye Name: [2-(2,5-difluorophenyl)-2-oxo-ethyl] 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid [2-(2,5-difluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-difluorophenyl)-2-oxoethyl] 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid [2-(2,5-difluorophenyl)-2-keto-ethyl] ester Formula: C16H12F2O5S MolecularWeight: 354.325286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12F2O5S/c1-24(21,22)12-5-2-10(3-6-12)16(20)23-9-15(19)13-8-11(17)4-7-14(13)18/h2-8H,9H2,1H3