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

SpectraBase Compound ID	9AjFHUooEWQ
InChI	InChI=1S/C19H20N2O7S2/c1-12-9-16(21-18(22)13(2)11-29(21,24)25)7-8-17(12)30(26,27)20-15-6-4-5-14(10-15)19(23)28-3/h4-10,13,20H,11H2,1-3H3
InChIKey	OILWQAIHPDNSHN-UHFFFAOYSA-N Google Search
Mol Weight	452.5 g/mol
Molecular Formula	C19H20N2O7S2
Exact Mass	452.071193 g/mol

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SpectraBase Spectrum ID	2cDQoD3WcAw
Name	benzoic acid, 3-[[[2-methyl-4-(4-methyl-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/C19H20N2O7S2/c1-12-9-16(21-18(22)13(2)11-29(21,24)25)7-8-17(12)30(26,27)20-15-6-4-5-14(10-15)19(23)28-3/h4-10,13,20H,11H2,1-3H3
InChIKey	OILWQAIHPDNSHN-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_8807
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: F33678; Labnumber: CHEKAN-00297