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7-(4-[1-[(Chloroacetyl)amino]-1-(ethoxycarbonyl)-2,2,2-trifluoroethyl]-1-piperazinyl)-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid

View entire compound with spectra: 2 MS (GC)

7-(4-[1-[(Chloroacetyl)amino]-1-(ethoxycarbonyl)-2,2,2-trifluoroethyl]-1-piperazinyl)-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
SpectraBase Compound ID JvBpR33KZfK
InChI InChI=1S/C24H25ClF4N4O6/c1-2-39-22(38)23(24(27,28)29,30-19(34)11-25)32-7-5-31(6-8-32)18-10-17-14(9-16(18)26)20(35)15(21(36)37)12-33(17)13-3-4-13/h9-10,12-13H,2-8,11H2,1H3,(H,30,34)(H,36,37)
InChIKey ORVRMLROBJTVFR-UHFFFAOYSA-N
Mol Weight 576.93 g/mol
Molecular Formula C24H25ClF4N4O6
Exact Mass 576.139875 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F9nfXOsi4Ew
Name 7-{4-[1-(2-CHLOROACETAMIDO)-1-ETHOXYCARBONYL-2,2,2-TRIFLUOROETHYL]-1-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C24H25ClF4N4O6
InChI InChI=1S/C24H25ClF4N4O6/c1-2-39-22(38)23(24(27,28)29,30-19(34)11-25)32-7-5-31(6-8-32)18-10-17-14(9-16(18)26)20(35)15(21(36)37)12-33(17)13-3-4-13/h9-10,12-13H,2-8,11H2,1H3,(H,30,34)(H,36,37)
InChIKey ORVRMLROBJTVFR-UHFFFAOYSA-N
Molecular Weight 576.1393
SMILES N(C(CCl)=O)C(N1CCN(c2c(cc3C(C(C(O)=O)=CN(c3c2)C2CC2)=O)F)CC1)(C(F)(F)F)C(OCC)=O
SPLASH splash10-004i-9110000000-92f57d2bd5b6513239a3
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany