Vitas-M small molecule compound

ethyl 2-{[(2Z)-2-(2,3-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}propanoate

Catalog ID
STK921614
SMILES CCOC(=O)C(Oc1ccc2c(c1)O/C(=C\c1cccc(c1OC)OC)/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 C22H22O7 MW 398.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22O7/c1-5-27-22(24)13(2)28-15-9-10-16-18(12-15)29-19(20(16)23)11-14-7-6-8-17(25-3)21(14)26-4/h6-13H,5H2,1-4H3/b19-11-
InChIKey
KPEAYAPUFVLCFZ-ODLFYWEKSA-N
Synonyms
620546-68-1
(Z)ethyl2((2(23dimethoxybenzylidene)3oxo23dihydrobenzofuran6yl)oxy)propanoate
620546681
CCOC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=CC3=C(C(=CC=C3)OC)OC)O2
CCOC(=O)C(Oc1ccc2c(c1)OC(=Cc1cccc(c1OC)OC)C2=O)C
ETHYL2(((2Z)2((23DIMETHOXYPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXY)PROPANOATE
ethyl2(((2Z)2(23dimethoxybenzylidene)3oxo23dihydro1benzofuran6yl)oxy)propanoate
ETHYL2(2((23DIMETHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)PROPANOATE
InChI=1SC22H22O7c152722(24)13(2)28159101618(1215)2919(20(16)23)111476817(253)21(14)264h613H5H214H3b1911
MFCD04146900
ZINC000005901089
ZINC000005901229

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.