Vitas-M small molecule compound

(2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2-chlorobenzoate

Catalog ID
STK993026
SMILES Clc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OC(=O)c2ccccc2Cl)c2c(c1)COCO2

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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 C24H14Cl2O6 MW 469.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H14Cl2O6/c25-15-7-13(23-14(8-15)11-29-12-30-23)9-21-22(27)18-6-5-16(10-20(18)32-21)31-24(28)17-3-1-2-4-19(17)26/h1-10H,11-12H2/b21-9-
InChIKey
TUFXTEWEQMXXRJ-NKVSQWTQSA-N
Synonyms
929380-68-7
((2Z)2((6chloro4H13benzodioxin8yl)methylidene)3oxo1benzofuran6yl)2chlorobenzoate
(2Z)2((6chloro4H13benzodioxin8yl)methylidene)3oxo23dihydro1benzofuran6yl2chlorobenzoate
(Z)2((6chloro4Hbenzo(d)(13)dioxin8yl)methylene)3oxo23dihydrobenzofuran6yl2chlorobenzoate
2((6CHLORO(2H4HBENZO(E)13DIOXIN8YL))METHYLENE)3OXOBENZO(34B)FURAN6YL2CHLOROBENZOATE
929380687
C1C2=C(C(=CC(=C2)Cl)C=C3C(=O)C4=C(O3)C=C(C=C4)OC(=O)C5=CC=CC=C5Cl)OCO1
Clc1cc(C=C2Oc3c(C2=O)ccc(c3)OC(=O)c2ccccc2Cl)c2c(c1)COCO2
InChI=1SC24H14Cl2O6c2515713(2314(815)1129123023)92122(27)186516(1020(18)3221)3124(28)17312419(17)26h110H1112H2b219
MFCD09847839
ZINC000008990965
ZINC08990965
ZINC8990965

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Available files

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