1-Ethyl-6-Fluoro-7-[4-(4-Nitrobenzoyl)-1-Piperazinyl]-4-Oxo-1,4-Dihydro-3-Quinolinecarboxylic Acid

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Properties Simple | Detailed

Formula C23H21FN4O6
IUPAC Name 1-ethyl-6-fluoro-7-[4-(4-nitrobenzoyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid
Molecular Mass 468.434 g·mol−1
Heat of Formation -610.3 ± 16.7 kJ·mol−1
Dipole Moment 3.27 ± 1.08 D
Volume 518.13 Å 3
Surface Area 439.39 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy 1.18 ± eV
Point Group Symmetry C1
Synonyms
  • 1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-((4-p-nitrobenzol)-1-piperazinyl)quinoline-3-carboxylic acid
  • 1-ethyl-6-fluoro-4-keto-7-[4-(4-nitrobenzoyl)piperazin-1-yl]quinoline-3-carboxylic acid
  • 1-ethyl-6-fluoro-7-[4-(4-nitrobenzoyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid
  • 1-ethyl-6-fluoro-7-[4-(4-nitrobenzoyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid
  • 1-ethyl-6-fluoro-7-[4-(4-nitrophenyl)carbonylpiperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid
  • 1-ethyl-6-fluoro-7-[4-[(4-nitrophenyl)-oxomethyl]-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid
  • 3-quinolinecarboxylic acid, 1-ethyl-6-fluoro-1,4-dihydro-7-(4-(4-nitrobenzoyl)-1-piperazinyl)-4-oxo-
  • efqca
CAS Number(s)
  • 135038-30-1
InChIKey NEFDOQJSXLBYRR-UHFFFAOYSA-N
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