[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] 2-chloranyl-4,5-bis(fluoranyl)benzoate

Systemtic Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] 2-chloranyl-4,5-bis(fluoranyl)benzoate Openeye Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl] 2-chloro-4,5-difluoro-benzoate CAS Name: 2-chloro-4,5-difluorobenzoic acid [2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl] 2-chloro-4,5-difluorobenzoate Traditional Name: 2-chloro-4,5-difluoro-benzoic acid [2-keto-2-(4-mesylpiperazino)ethyl] ester Formula: C14H15ClF2N2O5S MolecularWeight: 396.794106

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)COC(=O)C2=CC(=C(C=C2Cl)F)F

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)COC(=O)C2=CC(=C(C=C2Cl)F)F

InChI

InChI=1S/C14H15ClF2N2O5S/c1-25(22,23)19-4-2-18(3-5-19)13(20)8-24-14(21)9-6-11(16)12(17)7-10(9)15/h6-7H,2-5,8H2,1H3