Vitas-M small molecule compound

ethyl 4-(4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoate

Catalog ID
STK268076
SMILES CCOC(=O)c1ccc(cc1)N1C(=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 C17H9Cl4NO4 MW 433.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H9Cl4NO4/c1-2-26-17(25)7-3-5-8(6-4-7)22-15(23)9-10(16(22)24)12(19)14(21)13(20)11(9)18/h3-6H,2H2,1H3
InChIKey
ATEGLAYFDAXCHJ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl
ethyl4(4567tetrachloro13dioxo13dihydro2Hisoindol2yl)benzoate
ethyl4(4567tetrachloro13dioxoisoindol2yl)benzoate
InChI=1SC17H9Cl4NO4c122617(25)7358(647)2215(23)910(16(22)24)12(19)14(21)13(20)11(9)18h36H2H21H3
MFCD01046629
ZINC000000990298
ZINC00990298
ZINC990298

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.