Vitas-M small molecule compound
5-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzene-1,3-dicarboxylic acid
Catalog ID
STK295732
SMILES O=C1c2cc(ccc2C(=O)N1c1cc(cc(c1)C(=O)O)C(=O)O)Oc1ccc(cc1)[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 C22H12N2O9 MW 448.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H12N2O9/c25-19-17-6-5-16(33-15-3-1-13(2-4-15)24(31)32)10-18(17)20(26)23(19)14-8-11(21(27)28)7-12(9-14)22(29)30/h1-10H,(H,27,28)(H,29,30)InChIKey
LSJHCOUZCILFBZ-UHFFFAOYSA-NSynonyms
5(5(4nitrophenoxy)13dioxo13dihydro2Hisoindol2yl)benzene13dicarboxylicacid
5(5(4NITROPHENOXY)13DIOXOBENZO(C)AZOLIDIN2YL)BENZENE13DICARBOXYLICACID
5(5(4NITROPHENOXY)13DIOXOISOINDOL2YL)BENZENE13DICARBOXYLICACID
C1=CC(=CC=C1(N+)(=O)(O))OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC(=CC(=C4)C(=O)O)C(=O)O
InChI=1SC22H12N2O9c2519176516(33153113(2415)24(31)32)1018(17)20(26)23(19)14811(21(27)28)712(914)22(29)30h110H(H2728)(H2930)
MFCD00315630
O=C1c2cc(ccc2C(=O)N1c1cc(cc(c1)C(=O)O)C(=O)O)Oc1ccc(cc1)(N+)(=O)(O)
ZINC000003144055
ZINC3144055
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