benzoic acid, 4-[[[4-[[(5-methyl-3-isoxazolyl)amino]sulfonyl]phenyl]amino]carbonyl]-, methyl ester

SpectraBase Compound ID	DP2AiuqCuIc
InChI	InChI=1S/C19H17N3O6S/c1-12-11-17(21-28-12)22-29(25,26)16-9-7-15(8-10-16)20-18(23)13-3-5-14(6-4-13)19(24)27-2/h3-11H,1-2H3,(H,20,23)(H,21,22)
InChIKey	KADLYFAVVAKRCC-UHFFFAOYSA-N Google Search
Mol Weight	415.42 g/mol
Molecular Formula	C19H17N3O6S
Exact Mass	415.083806 g/mol

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SpectraBase Spectrum ID	7J0EzKEPubv
Name	benzoic acid, 4-[[[4-[[(5-methyl-3-isoxazolyl)amino]sulfonyl]phenyl]amino]carbonyl]-, 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/C19H17N3O6S/c1-12-11-17(21-28-12)22-29(25,26)16-9-7-15(8-10-16)20-18(23)13-3-5-14(6-4-13)19(24)27-2/h3-11H,1-2H3,(H,20,23)(H,21,22)
InChIKey	KADLYFAVVAKRCC-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB3_9000_2356
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/11268979