benzoic acid, 3-[[(2E)-2-[(4-bromobenzoyl)amino]-3-(4-methoxyphenyl)-1-oxo-2-propenyl]amino]-, methyl ester

SpectraBase Compound ID	7Av8KHq7C3X
InChI	InChI=1S/C25H21BrN2O5/c1-32-21-12-6-16(7-13-21)14-22(28-23(29)17-8-10-19(26)11-9-17)24(30)27-20-5-3-4-18(15-20)25(31)33-2/h3-15H,1-2H3,(H,27,30)(H,28,29)/b22-14+
InChIKey	ODAONHIXFKFGJH-HYARGMPZSA-N Google Search
Mol Weight	509.36 g/mol
Molecular Formula	C25H21BrN2O5
Exact Mass	508.063385 g/mol

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SpectraBase Spectrum ID	96sHJq1QLDL
Name	benzoic acid, 3-[[(2E)-2-[(4-bromobenzoyl)amino]-3-(4-methoxyphenyl)-1-oxo-2-propenyl]amino]-, methyl ester
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C25H21BrN2O5/c1-32-21-12-6-16(7-13-21)14-22(28-23(29)17-8-10-19(26)11-9-17)24(30)27-20-5-3-4-18(15-20)25(31)33-2/h3-15H,1-2H3,(H,27,30)(H,28,29)/b22-14+
InChIKey	ODAONHIXFKFGJH-HYARGMPZSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_3517_57
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: NMR/10318288