Vitas-M small molecule compound
[2-(2-nitrophenyl)-1,3-dioxo-1,2,3,3a,7,7a-hexahydro-4H-4,7-epoxyisoindol-4-yl]methanediyl diacetate
Catalog ID
STK257597
SMILES CC(=O)OC(C12C=CC(O1)C1C2C(=O)N(C1=O)c1ccccc1[N+](=O)[O-])OC(=O)C
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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 C19H16N2O9 MW 416.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O9/c1-9(22)28-18(29-10(2)23)19-8-7-13(30-19)14-15(19)17(25)20(16(14)24)11-5-3-4-6-12(11)21(26)27/h3-8,13-15,18H,1-2H3InChIKey
ZCAJZEBWTXTYLJ-UHFFFAOYSA-NSynonyms
(2(2nitrophenyl)13dioxo1233a77ahexahydro4H47epoxyisoindol4yl)methanediyldiacetate
(acetyloxy(2(2nitrophenyl)13dioxo77adihydro3aHoctahydro1H47epoxyisoindol4yl)methyl)acetate
CC(=O)OC(C12C=CC(O1)C1C2C(=O)N(C1=O)c1ccccc1(N+)(=O)(O))OC(=O)C
CC(=O)OC(C12C=CC(O1)C3C2C(=O)N(C3=O)C4=CC=CC=C4(N+)(=O)(O))OC(=O)C
InChI=1SC19H16N2O9c19(22)2818(2910(2)23)198713(3019)1415(19)17(25)20(16(14)24)11534612(11)21(26)27h38131518H12H3
MFCD00735214
ZINC000009356234
ZINC000239259358
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