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-methoxybenzoate
Catalog ID
STK621633
SMILES COc1ccccc1C(=O)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 C25H17ClO7 MW 464.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17ClO7/c1-29-20-5-3-2-4-19(20)25(28)32-17-6-7-18-21(11-17)33-22(23(18)27)10-14-8-16(26)9-15-12-30-13-31-24(14)15/h2-11H,12-13H2,1H3/b22-10-InChIKey
RUYJHVVEIUGZAY-YVNNLAQVSA-NSynonyms
929380-66-5((2Z)2((6chloro4H13benzodioxin8yl)methylidene)3oxo1benzofuran6yl)2methoxybenzoate
(2Z)2((6chloro4H13benzodioxin8yl)methylidene)3oxo23dihydro1benzofuran6yl2methoxybenzoate
(Z)2((6chloro4Hbenzo(d)(13)dioxin8yl)methylene)3oxo23dihydrobenzofuran6yl2methoxybenzoate
2((6CHLORO(2H4HBENZO(E)13DIOXAN8YL))METHYLENE)3OXOBENZO(34B)FURAN6YL2METHOXYBENZOATE
929380665
COC1=CC=CC=C1C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC(=CC5=C4OCOC5)Cl)O3
COc1ccccc1C(=O)Oc1ccc2c(c1)OC(=Cc1cc(Cl)cc3c1OCOC3)C2=O
InChI=1SC25H17ClO7c12920532419(20)25(28)3217671821(1117)3322(23(18)27)1014816(26)9151230133124(14)15h211H1213H21H3b2210
MFCD09798794
ZINC000009485110
ZINC09485110
ZINC9485110
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