2-[((2E)-2-cyano-3-{3-ethoxy-4-[(4-methylbenzoyl)oxy]phenyl}-2-propenoyl)amino]benzoic acid

SpectraBase Compound ID	4IV0gplxINL
InChI	InChI=1S/C27H22N2O6/c1-3-34-24-15-18(10-13-23(24)35-27(33)19-11-8-17(2)9-12-19)14-20(16-28)25(30)29-22-7-5-4-6-21(22)26(31)32/h4-15H,3H2,1-2H3,(H,29,30)(H,31,32)/b20-14+
InChIKey	WEMSLMOXFCJHNH-XSFVSMFZSA-N Google Search
Mol Weight	470.48 g/mol
Molecular Formula	C27H22N2O6
Exact Mass	470.147786 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	1KPpvmFESDc
Name	2-[((2E)-2-cyano-3-{3-ethoxy-4-[(4-methylbenzoyl)oxy]phenyl}-2-propenoyl)amino]benzoic acid
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/C27H22N2O6/c1-3-34-24-15-18(10-13-23(24)35-27(33)19-11-8-17(2)9-12-19)14-20(16-28)25(30)29-22-7-5-4-6-21(22)26(31)32/h4-15H,3H2,1-2H3,(H,29,30)(H,31,32)/b20-14+
InChIKey	WEMSLMOXFCJHNH-XSFVSMFZSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_5198
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: 9682617; UBI_ID: UBI-005200
Synonyms	2-[(2-cyano-3-{3-ethoxy-4-[(4-methylbenzoyl)oxy]phenyl}-2-propenoyl)amino]benzoic acid
Temperature	308 °C