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 (2E)-3-phenylprop-2-enoate
Catalog ID
STK627181
SMILES O=C(Oc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O)/C=C/c1ccccc1
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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 C26H17ClO6 MW 460.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17ClO6/c27-19-10-17(26-18(11-19)14-30-15-31-26)12-23-25(29)21-8-7-20(13-22(21)33-23)32-24(28)9-6-16-4-2-1-3-5-16/h1-13H,14-15H2/b9-6+,23-12-InChIKey
QBXBDNPTXIWDCG-LMKPGGDOSA-NSynonyms
929381-14-6((2Z)2((6chloro4H13benzodioxin8yl)methylidene)3oxo1benzofuran6yl)(E)3phenylprop2enoate
(2Z)2((6chloro4H13benzodioxin8yl)methylidene)3oxo23dihydro1benzofuran6yl(2E)3phenylprop2enoate
(Z)2((6chloro4Hbenzo(d)(13)dioxin8yl)methylene)3oxo23dihydrobenzofuran6ylcinnamate
2((6CHLORO(2H4HBENZO(E)13DIOXIN8YL))METHYLENE)3OXOBENZO(34B)FURAN6YL(2E)3PHENYLPROP2ENOATE
929381146
C1C2=C(C(=CC(=C2)Cl)C=C3C(=O)C4=C(O3)C=C(C=C4)OC(=O)C=CC5=CC=CC=C5)OCO1
InChI=1SC26H17ClO6c27191017(2618(1119)1430153126)122325(29)218720(1322(21)3323)3224(28)96164213516h113H1415H2b96+2312
MFCD09790730
O=C(Oc1ccc2c(c1)OC(=Cc1cc(Cl)cc3c1OCOC3)C2=O)C=Cc1ccccc1
ZINC000009047550
ZINC09047550
ZINC9047550
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