Vitas-M small molecule compound
ethyl 6-bromo-5-[(1-ethoxy-1-oxopropan-2-yl)oxy]-2-phenyl-1-benzofuran-3-carboxylate
Catalog ID
STK888062
SMILES CCOC(=O)c1c(oc2c1cc(OC(C(=O)OCC)C)c(c2)Br)c1ccccc1
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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)13(3)28-18-11-15-17(12-16(18)23)29-20(14-9-7-6-8-10-14)19(15)22(25)27-5-2/h6-13H,4-5H2,1-3H3InChIKey
VJSRAJQXWMIMKL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(OC2=CC(=C(C=C21)OC(C)C(=O)OCC)Br)C3=CC=CC=C3
ETHYL2(6BROMO3(ETHOXYCARBONYL)2PHENYLBENZO(B)FURAN5YLOXY)PROPANOATE
ethyl6bromo5((1ethoxy1oxopropan2yl)oxy)2phenyl1benzofuran3carboxylate
ETHYL6BROMO5(1ETHOXY1OXOPROPAN2YL)OXY2PHENYL1BENZOFURAN3CARBOXYLATE
ETHYL6BROMO5(2ETHOXY1METHYL2OXOETHOXY)2PHENYL1BENZOFURAN3CARBOXYLATE
InChI=1SC22H21BrO6c142621(24)13(3)2818111517(1216(18)23)2920(1497681014)19(15)22(25)2752h613H45H213H3
MFCD02167059
ZINC000000623798
ZINC000000623801
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