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ethyl [(3E)-3-({[(4-tert-butylbenzoyl)amino]acetyl}hydrazono)-2-oxo-2,3-dihydro-1H-indol-1-yl]acetate
SpectraBase Compound ID 5oN4rup143K
InChI InChI=1S/C25H28N4O5/c1-5-34-21(31)15-29-19-9-7-6-8-18(19)22(24(29)33)28-27-20(30)14-26-23(32)16-10-12-17(13-11-16)25(2,3)4/h6-13H,5,14-15H2,1-4H3,(H,26,32)(H,27,30)/b28-22+
InChIKey IQVCRPMOCCBLDC-XAYXJRQQSA-N
Mol Weight 464.52 g/mol
Molecular Formula C25H28N4O5
Exact Mass 464.20597 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GPLTcGY6I7i
Name Ethyl [(3E)-3-({[(4-tert-butylbenzoyl)amino]acetyl}hydrazono)-2-oxo-2,3-dihydro-1H-indol-1-yl]acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 464.205970013 u
Formula C25H28N4O5
InChI InChI=1S/C25H28N4O5/c1-5-34-21(31)15-29-19-9-7-6-8-18(19)22(24(29)33)28-27-20(30)14-26-23(32)16-10-12-17(13-11-16)25(2,3)4/h6-13H,5,14-15H2,1-4H3,(H,26,32)(H,27,30)/b28-22+
InChIKey IQVCRPMOCCBLDC-XAYXJRQQSA-N
Molecular Weight 464.522 g/mol
SMILES N(C(CNC(C=1C=CC(C(C)(C)C)=CC1)=O)=O)\N=C\1C(N(CC(=O)OCC)C2=C1C=CC=C2)=O