Vitas-M small molecule compound
3,3-dimethyl-2-oxobutyl 2-(4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoate
Catalog ID
STK275614
SMILES O=C(c1ccccc1N1C(=O)c2c(C1=O)c(Cl)c(c(c2Cl)Cl)Cl)OCC(=O)C(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 C21H15Cl4NO5 MW 503.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15Cl4NO5/c1-21(2,3)11(27)8-31-20(30)9-6-4-5-7-10(9)26-18(28)12-13(19(26)29)15(23)17(25)16(24)14(12)22/h4-7H,8H2,1-3H3InChIKey
CLNDZDOEAXXQFM-UHFFFAOYSA-NSynonyms
(33dimethyl2oxobutyl)2(4567tetrachloro13dioxoisoindol2yl)benzoate
33dimethyl2oxobutyl2(4567tetrachloro13dioxo13dihydro2Hisoindol2yl)benzoate
CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1N2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl
InChI=1SC21H15Cl4NO5c121(23)11(27)83120(30)9645710(9)2618(28)1213(19(26)29)15(23)17(25)16(24)14(12)22h47H8H213H3
MFCD03037423
ZINC000009094734
ZINC09094734
ZINC9094734
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