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

Systemtic Name: [2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl] 5-bromanyl-2-fluoranyl-benzoate Openeye Name: [2-(4-acetylpiperazin-1-yl)-2-oxo-ethyl] 5-bromo-2-fluoro-benzoate CAS Name: 5-bromo-2-fluorobenzoic acid [2-(4-acetyl-1-piperazinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetylpiperazin-1-yl)-2-oxoethyl] 5-bromo-2-fluorobenzoate Traditional Name: 5-bromo-2-fluoro-benzoic acid [2-(4-acetylpiperazino)-2-keto-ethyl] ester Formula: C15H16BrFN2O4 MolecularWeight: 387.200943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16BrFN2O4/c1-10(20)18-4-6-19(7-5-18)14(21)9-23-15(22)12-8-11(16)2-3-13(12)17/h2-3,8H,4-7,9H2,1H3