Vitas-M small molecule compound
ethyl 6-bromo-5-{[(2E)-4-ethoxy-4-oxobut-2-en-1-yl]oxy}-2-phenyl-1-benzofuran-3-carboxylate
Catalog ID
STK539346
SMILES CCOC(=O)c1c(oc2c1cc(OC/C=C/C(=O)OCC)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 C23H21BrO6 MW 473.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrO6/c1-3-27-20(25)11-8-12-29-19-13-16-18(14-17(19)24)30-22(15-9-6-5-7-10-15)21(16)23(26)28-4-2/h5-11,13-14H,3-4,12H2,1-2H3/b11-8+InChIKey
LJPWXOTYHDPRIU-DHZHZOJOSA-NSynonyms
308297-41-8(E)ethyl6bromo5((4ethoxy4oxobut2en1yl)oxy)2phenylbenzofuran3carboxylate
308297418
CCOC(=O)C=CCOC1=C(C=C2C(=C1)C(=C(O2)C3=CC=CC=C3)C(=O)OCC)Br
CCOC(=O)c1c(oc2c1cc(OCC=CC(=O)OCC)c(c2)Br)c1ccccc1
ETHYL(2E)4(6BROMO3(ETHOXYCARBONYL)2PHENYLBENZO(B)FURAN5YLOXY)BUT2ENOATE
ethyl6bromo5(((2E)4ethoxy4oxobut2en1yl)oxy)2phenyl1benzofuran3carboxylate
ETHYL6BROMO5((E)4ETHOXY4OXOBUT2ENOXY)2PHENYL1BENZOFURAN3CARBOXYLATE
InChI=1SC23H21BrO6c132720(25)118122919131618(1417(19)24)3022(1596571015)21(16)23(26)2842h5111314H3412H212H3b118+
MFCD02167114
ZINC000004531339
ZINC04531339
ZINC4531339
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