Vitas-M small molecule compound
5-{[(2-nitrophenoxy)acetyl]amino}benzene-1,3-dicarboxylic acid
Catalog ID
STK299701
SMILES O=C(Nc1cc(cc(c1)C(=O)O)C(=O)O)COc1ccccc1[N+](=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C16H12N2O8 MW 360.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O8/c19-14(8-26-13-4-2-1-3-12(13)18(24)25)17-11-6-9(15(20)21)5-10(7-11)16(22)23/h1-7H,8H2,(H,17,19)(H,20,21)(H,22,23)InChIKey
ULYRGXGHGRCCCT-UHFFFAOYSA-NSynonyms
5(((2nitrophenoxy)acetyl)amino)benzene13dicarboxylicacid
5(((2NITROPHENOXY)ACETYL)AMINO)ISOPHTHALICACID
5((2(2NITROPHENOXY)ACETYL)AMINO)BENZENE13DICARBOXYLICACID
C1=CC=C(C(=C1)(N+)(=O)(O))OCC(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O
InChI=1SC16H12N2O8c1914(82613421312(13)18(24)25)171169(15(20)21)510(711)16(22)23h17H8H2(H1719)(H2021)(H2223)
MFCD01974465
O=C(Nc1cc(cc(c1)C(=O)O)C(=O)O)COc1ccccc1(N+)(=O)(O)
ZINC000002979200
ZINC2979200
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