Vitas-M small molecule compound

{2-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-dioxo-1,2,3,3a,7,7a-hexahydro-4H-4,7-epoxyisoindol-4-yl}methanediyl diacetate

Catalog ID
STK257605
SMILES CC(=O)OC(C12C=CC(O1)C1C2C(=O)N(C1=O)c1ccc(c(c1)C(F)(F)F)Cl)OC(=O)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 C20H15ClF3NO7 MW 473.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClF3NO7/c1-8(26)30-18(31-9(2)27)19-6-5-13(32-19)14-15(19)17(29)25(16(14)28)10-3-4-12(21)11(7-10)20(22,23)24/h3-7,13-15,18H,1-2H3
InChIKey
XVLQOVRSYDPPQA-UHFFFAOYSA-N
Synonyms

(2(4chloro3(trifluoromethyl)phenyl)13dioxo1233a77ahexahydro4H47epoxyisoindol4yl)methanediyldiacetate
(acetyloxy(2(4chloro3(trifluoromethyl)phenyl)13dioxo77adihydro3aHoctahydro1H47epoxyisoindol4yl)methyl)acetate
CC(=O)OC(C12C=CC(O1)C3C2C(=O)N(C3=O)C4=CC(=C(C=C4)Cl)C(F)(F)F)OC(=O)C
InChI=1SC20H15ClF3NO7c18(26)3018(319(2)27)196513(3219)1415(19)17(29)25(16(14)28)103412(21)11(710)20(2223)24h37131518H12H3
MFCD03159007
ZINC000001092942
ZINC000239247998

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Available files

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