Vitas-M small molecule compound
ethyl 2-{[(2Z)-2-(2-bromobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}propanoate
Catalog ID
STK992526
SMILES CCOC(=O)C(Oc1ccc2c(c1)O/C(=C\c1ccccc1Br)/C2=O)C
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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 C20H17BrO5 MW 417.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrO5/c1-3-24-20(23)12(2)25-14-8-9-15-17(11-14)26-18(19(15)22)10-13-6-4-5-7-16(13)21/h4-12H,3H2,1-2H3/b18-10-InChIKey
OFTQNSWGUWDSAE-ZDLGFXPLSA-NSynonyms
620546-55-6(Z)ethyl2((2(2bromobenzylidene)3oxo23dihydrobenzofuran6yl)oxy)propanoate
620546556
CCOC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=CC3=CC=CC=C3Br)O2
CCOC(=O)C(Oc1ccc2c(c1)OC(=Cc1ccccc1Br)C2=O)C
ETHYL2(((2Z)2((2BROMOPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXY)PROPANOATE
ethyl2(((2Z)2(2bromobenzylidene)3oxo23dihydro1benzofuran6yl)oxy)propanoate
ETHYL2(2((2BROMOPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)PROPANOATE
InChI=1SC20H17BrO5c132420(23)12(2)2514891517(1114)2618(19(15)22)1013645716(13)21h412H3H212H3b1810
MFCD04166352
ZINC000009420550
ZINC000009420551
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