Vitas-M small molecule compound
2-(4-methylphenyl)-2-oxoethyl 3-(4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate
Catalog ID
STK247546
SMILES O=C(OCC(=O)c1ccc(cc1)C)CCN1C(=O)c2c(C1=O)c(Cl)c(c(c2Cl)Cl)Cl
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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 C20H13Cl4NO5 MW 489.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13Cl4NO5/c1-9-2-4-10(5-3-9)11(26)8-30-12(27)6-7-25-19(28)13-14(20(25)29)16(22)18(24)17(23)15(13)21/h2-5H,6-8H2,1H3InChIKey
AVGFGMAPRZCAAR-UHFFFAOYSA-NSynonyms
(2(4methylphenyl)2oxoethyl)3(4567tetrachloro13dioxoisoindol2yl)propanoate
2(4methylphenyl)2oxoethyl3(4567tetrachloro13dioxo13dihydro2Hisoindol2yl)propanoate
CC1=CC=C(C=C1)C(=O)COC(=O)CCN2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl
InChI=1SC20H13Cl4NO5c192410(539)11(26)83012(27)672519(28)1314(20(25)29)16(22)18(24)17(23)15(13)21h25H68H21H3
MFCD01174830
ZINC000000990576
ZINC00990576
ZINC990576
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