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 cyclopropanecarboxylate
Catalog ID
STK993067
SMILES O=C(C1CC1)Oc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=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 C21H15ClO6 MW 398.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15ClO6/c22-14-5-12(20-13(6-14)9-25-10-26-20)7-18-19(23)16-4-3-15(8-17(16)28-18)27-21(24)11-1-2-11/h3-8,11H,1-2,9-10H2/b18-7-InChIKey
SJAVBBQVAVOFLD-WSVATBPTSA-NSynonyms
929512-28-7((2Z)2((6chloro4H13benzodioxin8yl)methylidene)3oxo1benzofuran6yl)cyclopropanecarboxylate
(2Z)2((6chloro4H13benzodioxin8yl)methylidene)3oxo23dihydro1benzofuran6ylcyclopropanecarboxylate
(Z)2((6chloro4Hbenzo(d)(13)dioxin8yl)methylene)3oxo23dihydrobenzofuran6ylcyclopropanecarboxylate
2((6CHLORO(2H4HBENZO(E)13DIOXIN8YL))METHYLENE)3OXOBENZO(34B)FURAN6YLCYCLOPROPANECARBOXYLATE
929512287
C1CC1C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC(=CC5=C4OCOC5)Cl)O3
InChI=1SC21H15ClO6c2214512(2013(614)925102620)71819(23)164315(817(16)2818)2721(24)111211h3811H12910H2b187
MFCD09844919
O=C(C1CC1)Oc1ccc2c(c1)OC(=Cc1cc(Cl)cc3c1OCOC3)C2=O
ZINC000009484442
ZINC09484442
ZINC9484442
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