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N-(3-bromophenyl)-2-oxo-2-[(2E)-2-(4-{2-oxo-2-[(1-phenylethyl)amino]ethoxy}benzylidene)hydrazino]acetamide

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N-(3-bromophenyl)-2-oxo-2-[(2E)-2-(4-{2-oxo-2-[(1-phenylethyl)amino]ethoxy}benzylidene)hydrazino]acetamide
SpectraBase Compound ID 3tGhLzfJQN1
InChI InChI=1S/C25H23BrN4O4/c1-17(19-6-3-2-4-7-19)28-23(31)16-34-22-12-10-18(11-13-22)15-27-30-25(33)24(32)29-21-9-5-8-20(26)14-21/h2-15,17H,16H2,1H3,(H,28,31)(H,29,32)(H,30,33)/b27-15+
InChIKey VJBLYMFPMIGWFI-JFLMPSFJSA-N
Mol Weight 523.39 g/mol
Molecular Formula C25H23BrN4O4
Exact Mass 522.090268 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KxmNjkCyk6F
Name N-(3-Bromophenyl)-2-oxo-2-[(2E)-2-(4-{2-oxo-2-[(1-phenylethyl)amino]ethoxy}benzylidene)hydrazino]acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 522.090268233 u
Formula C25H23BrN4O4
InChI InChI=1S/C25H23BrN4O4/c1-17(19-6-3-2-4-7-19)28-23(31)16-34-22-12-10-18(11-13-22)15-27-30-25(33)24(32)29-21-9-5-8-20(26)14-21/h2-15,17H,16H2,1H3,(H,28,31)(H,29,32)(H,30,33)/b27-15+
InChIKey VJBLYMFPMIGWFI-JFLMPSFJSA-N
Molecular Weight 523.387 g/mol
SMILES N(C(C(=O)N\N=C\C=1C=CC(OCC(NC(C)C2=CC=CC=C2)=O)=CC1)=O)C1=CC(=CC=C1)Br