Vitas-M small molecule compound
{[(2Z)-2-(5-bromo-2-methoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetic acid
Catalog ID
STK600326
SMILES COc1ccc(cc1/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)O)Br
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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 C18H13BrO6 MW 405.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13BrO6/c1-23-14-5-2-11(19)6-10(14)7-16-18(22)13-4-3-12(8-15(13)25-16)24-9-17(20)21/h2-8H,9H2,1H3,(H,20,21)/b16-7-InChIKey
RUMZIPIEUHZYJY-APSNUPSMSA-NSynonyms
900897-73-6(((2Z)2(5bromo2methoxybenzylidene)3oxo23dihydro1benzofuran6yl)oxy)aceticacid
(Z)2((2(5bromo2methoxybenzylidene)3oxo23dihydrobenzofuran6yl)oxy)aceticacid
2(((2Z)2((5bromo2methoxyphenyl)methylidene)3oxo1benzofuran6yl)oxy)aceticacid
2(2((5BROMO2METHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)ACETICACID
900897736
COC1=C(C=C(C=C1)Br)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)O
COc1ccc(cc1C=C1Oc2c(C1=O)ccc(c2)OCC(=O)O)Br
InChI=1SC18H13BrO6c123145211(19)610(14)71618(22)134312(815(13)2516)24917(20)21h28H9H21H3(H2021)b167
MFCD06777211
ZINC000005269686
ZINC5269686
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