Vitas-M small molecule compound
2-(4-fluorophenyl)-2-oxoethyl 3-methyl-2-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate
Catalog ID
STK274896
SMILES Fc1ccc(cc1)C(=O)COC(=O)C(N1C(=O)c2c(C1=O)cccc2[N+](=O)[O-])C(C)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 C21H17FN2O7 MW 428.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17FN2O7/c1-11(2)18(21(28)31-10-16(25)12-6-8-13(22)9-7-12)23-19(26)14-4-3-5-15(24(29)30)17(14)20(23)27/h3-9,11,18H,10H2,1-2H3InChIKey
MTLNKYXMRDSVOC-UHFFFAOYSA-NSynonyms
(2(4FLUOROPHENYL)2OXOETHYL)3METHYL2(4NITRO13DIOXOISOINDOL2YL)BUTANOATE
2(4fluorophenyl)2oxoethyl3methyl2(4nitro13dioxo13dihydro2Hisoindol2yl)butanoate
CC(C)C(C(=O)OCC(=O)C1=CC=C(C=C1)F)N2C(=O)C3=C(C2=O)C(=CC=C3)(N+)(=O)(O)
Fc1ccc(cc1)C(=O)COC(=O)C(N1C(=O)c2c(C1=O)cccc2(N+)(=O)(O))C(C)C
InChI=1SC21H17FN2O7c111(2)18(21(28)311016(25)126813(22)9712)2319(26)1443515(24(29)30)17(14)20(23)27h391118H10H212H3
MFCD03146048
ZINC000002995628
ZINC000002995629
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