Vitas-M small molecule compound
5-{[(3-methyl-4-nitrophenyl)carbonyl]amino}benzene-1,3-dicarboxylic acid
Catalog ID
STK005783
SMILES O=C(c1ccc(c(c1)C)[N+](=O)[O-])Nc1cc(cc(c1)C(=O)O)C(=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 C16H12N2O7 MW 344.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O7/c1-8-4-9(2-3-13(8)18(24)25)14(19)17-12-6-10(15(20)21)5-11(7-12)16(22)23/h2-7H,1H3,(H,17,19)(H,20,21)(H,22,23)InChIKey
PHDWSUOHFUVBFY-UHFFFAOYSA-NSynonyms
5(((3METHYL4NITROPHENYL)CARBONYL)AMINO)BENZENE13DICARBOXYLICACID
5((3METHYL4NITROBENZOYL)AMINO)BENZENE13DICARBOXYLICACID
CC1=C(C=CC(=C1)C(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O)(N+)(=O)(O)
InChI=1SC16H12N2O7c1849(2313(8)18(24)25)14(19)1712610(15(20)21)511(712)16(22)23h27H1H3(H1719)(H2021)(H2223)
MFCD01159152
O=C(c1ccc(c(c1)C)(N+)(=O)(O))Nc1cc(cc(c1)C(=O)O)C(=O)O
STK005783
ZINC000004550363
ZINC4550363
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