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1-Cyclopropyl-7-(4-(1-(ethoxycarbonyl)-1-[(ethoxycarbonyl)amino]-2,2,2-trifluoroethyl)-1-piperazinyl)-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
SpectraBase Compound ID 4ABCnEkvGd3
InChI InChI=1S/C25H28F4N4O7/c1-3-39-22(37)24(25(27,28)29,30-23(38)40-4-2)32-9-7-31(8-10-32)19-12-18-15(11-17(19)26)20(34)16(21(35)36)13-33(18)14-5-6-14/h11-14H,3-10H2,1-2H3,(H,30,38)(H,35,36)
InChIKey MGALSPDJAJLEKT-UHFFFAOYSA-N
Mol Weight 572.51 g/mol
Molecular Formula C25H28F4N4O7
Exact Mass 572.189412 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BBvJtrF8LK8
Name 1-Cyclopropyl-7-(4-(1-(ethoxycarbonyl)-1-[(ethoxycarbonyl)amino]-2,2,2-trifluoroethyl)-1-piperazinyl)-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
Alternate Name(s) 1-cyclopropyl-7-[4-[1-ethoxycarbonyl-1-(ethoxycarbonylamino)-2,2,2-trifluoro-ethyl]piperazin-1-yl]-6-fluoro-4-oxo-quinoline-3-carboxylic acid 1-cyclopropyl-7-[4-[3-ethoxy-2-(ethoxycarbonylamino)-1,1,1-trifluoro-3-oxopropan-2-yl]-1-piperazinyl]-6-fluoro-4-oxo-3-quinolinecarboxylic acid 1-cyclopropyl-7-[4-[3-ethoxy-2-(ethoxycarbonylamino)-1,1,1-trifluoro-3-oxopropan-2-yl]piperazin-1-yl]-6-fluoro-4-oxoquinoline-3-carboxylic acid 1-cyclopropyl-7-[4-[3-ethoxy-2-(ethoxycarbonylamino)-1,1,1-tris(fluoranyl)-3-oxidanylidene-propan-2-yl]piperazin-1-yl]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid 7-[4-[1-carbethoxy-1-(carbethoxyamino)-2,2,2-trifluoro-ethyl]piperazino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid
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Formula C25H28F4N4O7
InChI InChI=1S/C25H28F4N4O7/c1-3-39-22(37)24(25(27,28)29,30-23(38)40-4-2)32-9-7-31(8-10-32)19-12-18-15(11-17(19)26)20(34)16(21(35)36)13-33(18)14-5-6-14/h11-14H,3-10H2,1-2H3,(H,30,38)(H,35,36)
InChIKey MGALSPDJAJLEKT-UHFFFAOYSA-N
Molecular Weight 572.514 g/mol
SMILES N(C(N1CCN(c2c(cc3c(N(C=C(C(=O)O)C3=O)C3CC3)c2)F)CC1)(C(=O)OCC)C(F)(F)F)C(=O)OCC
SPLASH splash10-006w-9630000000-08cf8e9d5e50c6cae79f
Wiley ID 1468620