2-[N-(Diethoxycarbonyl)(phenyloxy)methyl]amino-4-nitrobenzoic acid

SpectraBase Compound ID	FSF1w6nTmpJ
InChI	InChI=1S/C20H20N2O9/c1-3-29-18(25)20(19(26)30-4-2,31-14-8-6-5-7-9-14)21-16-12-13(22(27)28)10-11-15(16)17(23)24/h5-12,21H,3-4H2,1-2H3,(H,23,24)
InChIKey	KLJMIWJVQDCUEO-UHFFFAOYSA-N Google Search
Mol Weight	432.39 g/mol
Molecular Formula	C20H20N2O9
Exact Mass	432.11688 g/mol

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SpectraBase Spectrum ID	Ekm5EnqNKan
Name	2-[N-(Diethoxycarbonyl)(phenyloxy)methyl]amino-4-nitrobenzoic acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H20N2O9
InChI	InChI=1S/C20H20N2O9/c1-3-29-18(25)20(19(26)30-4-2,31-14-8-6-5-7-9-14)21-16-12-13(22(27)28)10-11-15(16)17(23)24/h5-12,21H,3-4H2,1-2H3,(H,23,24)
InChIKey	KLJMIWJVQDCUEO-UHFFFAOYSA-N
Molecular Weight	432.385 g/mol
SMILES	N(C(C(=O)OCC)(C(=O)OCC)Oc1ccccc1)c1c(C(=O)O)ccc(c1)N(=O)=O
SPLASH	splash10-01t9-0940000000-fe4bc8b3c928d8ad1ef3
Source of Spectrum	SO-0-658-9
Synonyms	2-{[2-ethoxy-1-(ethoxycarbonyl)-2-oxo-1-phenoxyethyl]amino}-4-nitrobenzoic acid
Wiley ID	1537970