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

SpectraBase Compound ID	CjnICZbb7K1
InChI	InChI=1S/C23H16N2O6S/c24-15-18(22(26)25-19-6-4-5-17(14-19)23(27)28)13-16-9-11-20(12-10-16)31-32(29,30)21-7-2-1-3-8-21/h1-14H,(H,25,26)(H,27,28)/b18-13+
InChIKey	ZJXSPSOJIJHSHQ-QGOAFFKASA-N Google Search
Mol Weight	448.45 g/mol
Molecular Formula	C23H16N2O6S
Exact Mass	448.072907 g/mol

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SpectraBase Spectrum ID	5jBNlAgCuLR
Name	3-[((2E)-2-cyano-3-{4-[(phenylsulfonyl)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/C23H16N2O6S/c24-15-18(22(26)25-19-6-4-5-17(14-19)23(27)28)13-16-9-11-20(12-10-16)31-32(29,30)21-7-2-1-3-8-21/h1-14H,(H,25,26)(H,27,28)/b18-13+
InChIKey	ZJXSPSOJIJHSHQ-QGOAFFKASA-N
NMR Offset	17.5285
NMR Spectrometer Frequency	500.138
Observed nucleus	1H
Origin	1H_UZI_26187_2822
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: UZI/1010224; Labnumber: ARF4030; UZI_ID: UZI-002824
Synonyms	3-[(2-cyano-3-{4-[(phenylsulfonyl)oxy]phenyl}-2-propenoyl)amino]benzoic acid
Temperature	300 °C