Vitas-M small molecule compound
3-(2-bromophenoxy)-8-(morpholin-4-ium-4-ylmethyl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Catalog ID
STK584625
SMILES [O-]c1ccc2c(c1C[NH+]1CCOCC1)oc(c(c2=O)Oc1ccccc1Br)C(F)(F)F
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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 C21H17BrF3NO5 MW 500.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrF3NO5/c22-14-3-1-2-4-16(14)30-19-17(28)12-5-6-15(27)13(11-26-7-9-29-10-8-26)18(12)31-20(19)21(23,24)25/h1-6,27H,7-11H2InChIKey
BVVBYHKGUSTGPD-UHFFFAOYSA-NSynonyms
303121-67-7(O)c1ccc2c(c1C(NH+)1CCOCC1)oc(c(c2=O)Oc1ccccc1Br)C(F)(F)F
3(2BROMOPHENOXY)7HYDROXY8(4MORPHOLINYLMETHYL)2(TRIFLUOROMETHYL)4HCHROMEN4ONE
3(2BROMOPHENOXY)7HYDROXY8(MORPHOLIN4YLMETHYL)2(TRIFLUOROMETHYL)CHROMEN4ONE
3(2bromophenoxy)8(morpholin4ium4ylmethyl)4oxo2(trifluoromethyl)4Hchromen7olate
303121677
C1COCCN1CC2=C(C=CC3=C2OC(=C(C3=O)OC4=CC=CC=C4Br)C(F)(F)F)O
InChI=1SC21H17BrF3NO5c2214312416(14)301917(28)125615(27)13(1126792910826)18(12)3120(19)21(2324)25h1627H711H2
MFCD02071883
ZINC000019790391
ZINC19790391
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