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N,N'-BIS-[2-(DIMETHYLAMINO)-ETHYL]-4-CHLORO-7-OXO-7H-DIBENZ-[F,IJ]-ISOQUINOLIN-2,8-DICARBOXAMIDE
SpectraBase Compound ID 46k3GI5aYbD
InChI InChI=1S/C26H28ClN5O3/c1-31(2)12-10-28-25(34)17-7-5-6-15-18-14-20(26(35)29-11-13-32(3)4)30-23-19(27)9-8-16(21(18)23)24(33)22(15)17/h5-9,14H,10-13H2,1-4H3,(H,28,34)(H,29,35)
InChIKey XEBULKHLMWRKER-UHFFFAOYSA-N
Mol Weight 494.0 g/mol
Molecular Formula C26H28ClN5O3
Exact Mass 493.188067 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EV65PpGF7M
Name N,N'-BIS-[2-(DIMETHYLAMINO)-ETHYL]-4-CHLORO-7-OXO-7H-DIBENZ-[F,IJ]-ISOQUINOLIN-2,8-DICARBOXAMIDE
Compound Number 29
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H28ClN5O3
InChI InChI=1S/C26H28ClN5O3/c1-31(2)12-10-28-25(34)17-7-5-6-15-18-14-20(26(35)29-11-13-32(3)4)30-23-19(27)9-8-16(21(18)23)24(33)22(15)17/h5-9,14H,10-13H2,1-4H3,(H,28,34)(H,29,35)
InChIKey XEBULKHLMWRKER-UHFFFAOYSA-N
Literature Reference Author X.BU,L.W.DEADY,G.J.FINLAY,B.C.BAGULEY,W.A.DENNY
Literature Reference Citation J.MED.CHEM.,44,2004(2001)
Literature Reference DOI 10.1021/jm010041l
Molecular Weight 493.993 g/mol
Sample ID 44542
Solvent CDCl3