5-Acetyl-2-[[(2-chloro-5-nitrophenyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester

SpectraBase Compound ID	BPvlFCjD7Tu
InChI	InChI=1S/C17H15ClN2O6S/c1-4-26-17(23)13-8(2)14(9(3)21)27-16(13)19-15(22)11-7-10(20(24)25)5-6-12(11)18/h5-7H,4H2,1-3H3,(H,19,22)
InChIKey	BYIXFSGAFISCPL-UHFFFAOYSA-N Google Search
Mol Weight	410.83 g/mol
Molecular Formula	C17H15ClN2O6S
Exact Mass	410.033935 g/mol

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SpectraBase Spectrum ID	H1u7FXsc2s2
Name	3-thiophenecarboxylic acid, 5-acetyl-2-[(2-chloro-5-nitrobenzoyl)amino]-4-methyl-, ethyl ester
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	410.033935079 u
Formula	C17H15ClN2O6S
InChI	InChI=1S/C17H15ClN2O6S/c1-4-26-17(23)13-8(2)14(9(3)21)27-16(13)19-15(22)11-7-10(20(24)25)5-6-12(11)18/h5-7H,4H2,1-3H3,(H,19,22)
InChIKey	BYIXFSGAFISCPL-UHFFFAOYSA-N
Molecular Weight	410.828 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_15447
Solvent	DMSO-d6
Source	Vendor ID: ZI/10023270; Lab Info: PNA; Lab Number: PNA-1991119