Vitas-M small molecule compound
ethyl 4-({8-[(dimethylamino)methyl]-7-hydroxy-4-oxo-2-(trifluoromethyl)-4H-chromen-3-yl}oxy)benzoate
Catalog ID
STK921693
SMILES CCOC(=O)c1ccc(cc1)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)CN(C)C)O
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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 C22H20F3NO6 MW 451.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20F3NO6/c1-4-30-21(29)12-5-7-13(8-6-12)31-19-17(28)14-9-10-16(27)15(11-26(2)3)18(14)32-20(19)22(23,24)25/h5-10,27H,4,11H2,1-3H3InChIKey
SNOWNHBSHLINQR-UHFFFAOYSA-NSynonyms
848212-80-68((DIMETHYLAZANIUMYL)METHYL)3(4ETHOXYCARBONYLPHENOXY)4OXO2(TRIFLUOROMETHYL)CHROMEN7OLATE
848212806
CCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3C(NH+)(C)C)(O))C(F)(F)F
ethyl4((8((dimethylamino)methyl)7hydroxy4oxo2(trifluoromethyl)4Hchromen3yl)oxy)benzoate
ETHYL4(8((DIMETHYLAMINO)METHYL)7HYDROXY4OXO2(TRIFLUOROMETHYL)CHROMEN3YLOXY)BENZOATE
ETHYL4(8(DIMETHYLAMINOMETHYL)7HYDROXY4OXO2(TRIFLUOROMETHYL)CHROMEN3YL)OXYBENZOATE
InChI=1SC22H20F3NO6c143021(29)125713(8612)311917(28)1491016(27)15(1126(2)3)18(14)3220(19)22(2324)25h51027H411H213H3
MFCD04188696
ZINC000009329076
ZINC9329076
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