Vitas-M small molecule compound
ethyl 6-bromo-5-(2-ethoxy-2-oxo-1-phenylethoxy)-2-methyl-1-benzofuran-3-carboxylate
Catalog ID
STK840452
SMILES CCOC(=O)C(c1ccccc1)Oc1cc2c(cc1Br)oc(c2C(=O)OCC)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 C22H21BrO6 MW 461.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21BrO6/c1-4-26-21(24)19-13(3)28-17-12-16(23)18(11-15(17)19)29-20(22(25)27-5-2)14-9-7-6-8-10-14/h6-12,20H,4-5H2,1-3H3InChIKey
DVDGEAVPECVRKE-UHFFFAOYSA-NSynonyms
385418-50-8385418508
CCOC(=O)C1=C(OC2=CC(=C(C=C21)OC(C3=CC=CC=C3)C(=O)OCC)Br)C
ETHYL2(6BROMO3(ETHOXYCARBONYL)2METHYLBENZO(B)FURAN5YLOXY)2PHENYLACETATE
ethyl6bromo5(2ethoxy2oxo1phenylethoxy)2methyl1benzofuran3carboxylate
ETHYL6BROMO5(2ETHOXY2OXO1PHENYLETHOXY)2METHYLBENZOFURAN3CARBOXYLATE
InChI=1SC22H21BrO6c142621(24)1913(3)28171216(23)18(1115(17)19)2920(22(25)2752)1497681014h61220H45H213H3
MFCD03146729
ZINC000001155988
ZINC000001155989
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