Vitas-M small molecule compound

2-(3-nitrophenyl)-2-oxoethyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate

Catalog ID
STK268239
SMILES O=C(CN1C(=O)c2c(C1=O)c(Cl)c(c(c2Cl)Cl)Cl)OCC(=O)c1cccc(c1)[N+](=O)[O-]

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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 C18H8Cl4N2O7 MW 506.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H8Cl4N2O7/c19-13-11-12(14(20)16(22)15(13)21)18(28)23(17(11)27)5-10(26)31-6-9(25)7-2-1-3-8(4-7)24(29)30/h1-4H,5-6H2
InChIKey
WACMGBHURZBOAM-UHFFFAOYSA-N
Synonyms

(2(3nitrophenyl)2oxoethyl)2(4567tetrachloro13dioxoisoindol2yl)acetate
2(3nitrophenyl)2oxoethyl(4567tetrachloro13dioxo13dihydro2Hisoindol2yl)acetate
C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)COC(=O)CN2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl
InChI=1SC18H8Cl4N2O7c19131112(14(20)16(22)15(13)21)18(28)23(17(11)27)510(26)3169(25)72138(47)24(29)30h14H56H2
MFCD01068366
O=C(CN1C(=O)c2c(C1=O)c(Cl)c(c(c2Cl)Cl)Cl)OCC(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000000990360
ZINC00990360
ZINC990360

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Available files

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