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2-(4-Chlorophenyl)-N-[2-keto-2-[(N'Z)-N'-(2-keto-1-propargyl-indolin-3-ylidene)hydrazino]ethyl]acetamide
SpectraBase Compound ID 8DL2Trh5tDK
InChI InChI=1S/C21H17ClN4O3/c1-2-11-26-17-6-4-3-5-16(17)20(21(26)29)25-24-19(28)13-23-18(27)12-14-7-9-15(22)10-8-14/h1,3-10H,11-13H2,(H,23,27)(H,24,28)/b25-20-
InChIKey PQWBBJGVJANQOQ-QQTULTPQSA-N
Mol Weight 408.85 g/mol
Molecular Formula C21H17ClN4O3
Exact Mass 408.098918 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AoTa3IjFGqR
Name 2-(4-Chlorophenyl)-N-[2-keto-2-[(N'Z)-N'-(2-keto-1-propargyl-indolin-3-ylidene)hydrazino]ethyl]acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 408.098918120 u
Formula C21H17ClN4O3
InChI InChI=1S/C21H17ClN4O3/c1-2-11-26-17-6-4-3-5-16(17)20(21(26)29)25-24-19(28)13-23-18(27)12-14-7-9-15(22)10-8-14/h1,3-10H,11-13H2,(H,23,27)(H,24,28)/b25-20-
InChIKey PQWBBJGVJANQOQ-QQTULTPQSA-N
Molecular Weight 408.845 g/mol
SMILES C1(\C(C2=C(N1CC#C)C=CC=C2)=N/NC(=O)CNC(=O)CC1=CC=C(C=C1)Cl)=O