benzoic acid, 4-chloro-3-[[[4-(4,4-dimethyl-1,1-dioxido-3-oxo-2-isothiazolidinyl)phenyl]sulfonyl]amino]-, methyl ester

SpectraBase Compound ID	JNKNLOXvtyD
InChI	InChI=1S/C19H19ClN2O7S2/c1-19(2)11-30(25,26)22(18(19)24)13-5-7-14(8-6-13)31(27,28)21-16-10-12(17(23)29-3)4-9-15(16)20/h4-10,21H,11H2,1-3H3
InChIKey	IYEFYGXEQQDZDE-UHFFFAOYSA-N Google Search
Mol Weight	486.94 g/mol
Molecular Formula	C19H19ClN2O7S2
Exact Mass	486.032221 g/mol

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SpectraBase Spectrum ID	EU4cpNRRn5u
Name	benzoic acid, 4-chloro-3-[[[4-(4,4-dimethyl-1,1-dioxido-3-oxo-2-isothiazolidinyl)phenyl]sulfonyl]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/C19H19ClN2O7S2/c1-19(2)11-30(25,26)22(18(19)24)13-5-7-14(8-6-13)31(27,28)21-16-10-12(17(23)29-3)4-9-15(16)20/h4-10,21H,11H2,1-3H3
InChIKey	IYEFYGXEQQDZDE-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_8782
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: F33646; Labnumber: CHEKAN-00138