Benzoic acid, 3-[(2-nitrobenzoyl)amino]-, ethyl ester

SpectraBase Compound ID	A6hZRrQsCSd
InChI	InChI=1S/C16H14N2O5/c1-2-23-16(20)11-6-5-7-12(10-11)17-15(19)13-8-3-4-9-14(13)18(21)22/h3-10H,2H2,1H3,(H,17,19)
InChIKey	YUUCAWOXUBEMCE-UHFFFAOYSA-N Google Search
Mol Weight	314.3 g/mol
Molecular Formula	C16H14N2O5
Exact Mass	314.090272 g/mol

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SpectraBase Spectrum ID	KIwcpmI0hDK
Name	Benzoic acid, 3-[(2-nitrobenzoyl)amino]-, ethyl ester
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	314.090271554 u
Formula	C16H14N2O5
InChI	InChI=1S/C16H14N2O5/c1-2-23-16(20)11-6-5-7-12(10-11)17-15(19)13-8-3-4-9-14(13)18(21)22/h3-10H,2H2,1H3,(H,17,19)
InChIKey	YUUCAWOXUBEMCE-UHFFFAOYSA-N
Molecular Weight	314.297 g/mol
SMILES	CCOC(C1=CC(NC(C2=C(N(=O)=O)C=CC=C2)=O)=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR)	0.840757