Vitas-M small molecule compound
prop-2-en-1-yl {[(2Z)-2-(5-bromo-2-methoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetate
Catalog ID
STK921662
SMILES C=CCOC(=O)COc1ccc2c(c1)O/C(=C\c1cc(Br)ccc1OC)/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 C21H17BrO6 MW 445.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrO6/c1-3-8-26-20(23)12-27-15-5-6-16-18(11-15)28-19(21(16)24)10-13-9-14(22)4-7-17(13)25-2/h3-7,9-11H,1,8,12H2,2H3/b19-10-InChIKey
HFSMQLJCSMCPMW-GRSHGNNSSA-NSynonyms
622813-87-0(Z)allyl2((2(5bromo2methoxybenzylidene)3oxo23dihydrobenzofuran6yl)oxy)acetate
622813870
C=CCOC(=O)COc1ccc2c(c1)OC(=Cc1cc(Br)ccc1OC)C2=O
COC1=C(C=C(C=C1)Br)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)OCC=C
InChI=1SC21H17BrO6c1382620(23)122715561618(1115)2819(21(16)24)1013914(22)4717(13)252h37911H1812H22H3b1910
MFCD04184553
prop2en1yl(((2Z)2(5bromo2methoxybenzylidene)3oxo23dihydro1benzofuran6yl)oxy)acetate
PROP2ENYL2(((2Z)2((5BROMO2METHOXYPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXY)ACETATE
PROP2ENYL2(2((5BROMO2METHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)ACETATE
ZINC000002398434
ZINC02398434
ZINC2398434
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