Vitas-M small molecule compound
2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Catalog ID
STK269536
SMILES O=C1C2C3C=CC(C2C(=O)N1c1ccccc1C(=O)OCC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl)C3
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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 C24H17ClN2O7 MW 480.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17ClN2O7/c25-16-8-7-12(10-18(16)27(32)33)19(28)11-34-24(31)15-3-1-2-4-17(15)26-22(29)20-13-5-6-14(9-13)21(20)23(26)30/h1-8,10,13-14,20-21H,9,11H2InChIKey
HRIZMLSRXBNFRM-UHFFFAOYSA-NSynonyms
2(4chloro3nitrophenyl)2oxoethyl2(13dioxo133a477ahexahydro2H47methanoisoindol2yl)benzoate
C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=CC=C4C(=O)OCC(=O)C5=CC(=C(C=C5)Cl)(N+)(=O)(O)
InChI=1SC24H17ClN2O7c25168712(1018(16)27(32)33)19(28)113424(31)15312417(15)2622(29)20135614(913)21(20)23(26)30h181013142021H911H2
MFCD02318635
O=C1C2C3C=CC(C2C(=O)N1c1ccccc1C(=O)OCC(=O)c1ccc(c(c1)(N+)(=O)(O))Cl)C3
ZINC000100641351
ZINC000239309547
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