[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] 5-bromanyl-2-fluoranyl-benzoate

Systemtic Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] 5-bromanyl-2-fluoranyl-benzoate Openeye Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl] 5-bromo-2-fluoro-benzoate CAS Name: 5-bromo-2-fluorobenzoic acid [2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl] 5-bromo-2-fluorobenzoate Traditional Name: 5-bromo-2-fluoro-benzoic acid [2-keto-2-(4-mesylpiperazino)ethyl] ester Formula: C14H16BrFN2O5S MolecularWeight: 423.254643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16BrFN2O5S/c1-24(21,22)18-6-4-17(5-7-18)13(19)9-23-14(20)11-8-10(15)2-3-12(11)16/h2-3,8H,4-7,9H2,1H3