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1-(o-Cyanophenyl)-7-(piperazin-1'-yl)-3-(hydroxycarnonyl)-6-fluoro-1,4-dihydro-4-quinolone
SpectraBase Compound ID 8demb1dsZ2E
InChI InChI=1S/C21H17FN4O3/c22-16-9-14-18(10-19(16)25-7-5-24-6-8-25)26(12-15(20(14)27)21(28)29)17-4-2-1-3-13(17)11-23/h1-4,9-10,12,24H,5-8H2,(H,28,29)
InChIKey ZXSZGOOQKBOGGK-UHFFFAOYSA-N
Mol Weight 392.39 g/mol
Molecular Formula C21H17FN4O3
Exact Mass 392.128469 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F0YvjwT2Atl
Name 1-(o-Cyanophenyl)-7-(piperazin-1'-yl)-3-(hydroxycarnonyl)-6-fluoro-1,4-dihydro-4-quinolone
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Formula C21H17FN4O3
InChI InChI=1S/C21H17FN4O3/c22-16-9-14-18(10-19(16)25-7-5-24-6-8-25)26(12-15(20(14)27)21(28)29)17-4-2-1-3-13(17)11-23/h1-4,9-10,12,24H,5-8H2,(H,28,29)
InChIKey ZXSZGOOQKBOGGK-UHFFFAOYSA-N
Molecular Weight 392.390 g/mol
SMILES N1CCN(c2c(cc3c(N(C=C(C(=O)O)C3=O)c3c(C#N)cccc3)c2)F)CC1
SPLASH splash10-0udl-1009000000-ca03a866d5e0ef9eea95
Source of Spectrum D8-329-189-6
Synonyms 1-(2-cyanophenyl)-6-fluoro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid 1-(2-cyanophenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid 1-(2-cyanophenyl)-6-fluoro-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid 1-(2-cyanophenyl)-6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid
Wiley ID 1516137