Vitas-M small molecule compound
ethyl 2-{[3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl]oxy}butanoate
Catalog ID
STK969846
SMILES CCOC(=O)C(Oc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1Br)C(F)(F)F)CC
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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 C22H18BrF3O6 MW 515.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrF3O6/c1-3-15(21(28)29-4-2)30-12-9-10-13-17(11-12)32-20(22(24,25)26)19(18(13)27)31-16-8-6-5-7-14(16)23/h5-11,15H,3-4H2,1-2H3InChIKey
JEKWPNHHUXQQBB-UHFFFAOYSA-NSynonyms
316126-82-6316126826
CCC(C(=O)OCC)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=CC=C3Br
ETHYL(2S)2((3(2BROMOPHENOXY)4OXO2(TRIFLUOROMETHYL)4HCHROMEN7YL)OXY)BUTANOATE
ethyl2((3(2bromophenoxy)4oxo2(trifluoromethyl)4Hchromen7yl)oxy)butanoate
ETHYL2(3(2BROMOPHENOXY)4OXO2(TRIFLUOROMETHYL)CHROMEN7YL)OXYBUTANOATE
InChI=1SC22H18BrF3O6c1315(21(28)2942)30129101317(1112)3220(22(2425)26)19(18(13)27)3116865714(16)23h51115H34H212H3
MFCD02073157
ZINC000001904851
ZINC000001904853
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