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1-Piperazinecarboxylic acid, 4-[[1-cyclopropyl-7-(4-ethyl-1-piperazinyl)-6-fluoro-1,4-dihydro-4-oxo-3-quinolinyl]carbonyl]-, ethyl ester
SpectraBase Compound ID 6XsThoLQU9G
InChI InChI=1S/C26H34FN5O4/c1-3-28-7-9-29(10-8-28)23-16-22-19(15-21(23)27)24(33)20(17-32(22)18-5-6-18)25(34)30-11-13-31(14-12-30)26(35)36-4-2/h15-18H,3-14H2,1-2H3
InChIKey ZGWPCCKRRBKVDQ-UHFFFAOYSA-N
Mol Weight 499.6 g/mol
Molecular Formula C26H34FN5O4
Exact Mass 499.259483 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9X8ZidOKARK
Name 1-Piperazinecarboxylic acid, 4-[[1-cyclopropyl-7-(4-ethyl-1-piperazinyl)-6-fluoro-1,4-dihydro-4-oxo-3-quinolinyl]carbonyl]-, ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 499.259482754 u
Formula C26H34FN5O4
InChI InChI=1S/C26H34FN5O4/c1-3-28-7-9-29(10-8-28)23-16-22-19(15-21(23)27)24(33)20(17-32(22)18-5-6-18)25(34)30-11-13-31(14-12-30)26(35)36-4-2/h15-18H,3-14H2,1-2H3
InChIKey ZGWPCCKRRBKVDQ-UHFFFAOYSA-N
Molecular Weight 499.587 g/mol
SMILES C=1(C(C2=CC(F)=C(C=C2N(C1)C1CC1)N1CCN(CC1)CC)=O)C(N1CCN(CC1)C(=O)OCC)=O