Vitas-M small molecule compound
8-[(diethylammonio)methyl]-3-(2-methoxyphenyl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Catalog ID
STK590586
SMILES COc1ccccc1c1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+](CC)CC)[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 C22H22F3NO4 MW 421.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22F3NO4/c1-4-26(5-2)12-15-16(27)11-10-14-19(28)18(13-8-6-7-9-17(13)29-3)21(22(23,24)25)30-20(14)15/h6-11,27H,4-5,12H2,1-3H3InChIKey
UVDQHGNTHJYSAP-UHFFFAOYSA-NSynonyms
303119-45-1303119451
8((DIETHYLAMINO)METHYL)7HYDROXY3(2METHOXYPHENYL)2(TRIFLUOROMETHYL)CHROMEN4ONE
8((diethylammonio)methyl)3(2methoxyphenyl)4oxo2(trifluoromethyl)4Hchromen7olate
8((diethylazaniumyl)methyl)3(2methoxyphenyl)4oxo2(trifluoromethyl)chromen7olate
8(DIETHYLAMINOMETHYL)7HYDROXY3(2METHOXYPHENYL)2(TRIFLUOROMETHYL)CHROMEN4ONE
CC(NH+)(CC)CC1=C(C=CC2=C1OC(=C(C2=O)C3=CC=CC=C3OC)C(F)(F)F)(O)
COc1ccccc1c1c(=O)c2ccc(c(c2oc1C(F)(F)F)C(NH+)(CC)CC)(O)
InChI=1SC22H22F3NO4c1426(52)121516(27)11101419(28)18(13867917(13)293)21(22(2324)25)3020(14)15h61127H4512H213H3
MFCD02081742
ZINC000019790366
ZINC19790366
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