Vitas-M small molecule compound
8-[(dimethylammonio)methyl]-3-(3-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Catalog ID
STK856896
SMILES COc1cccc(c1)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+](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 C20H18F3NO5 MW 409.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18F3NO5/c1-24(2)10-14-15(25)8-7-13-16(26)18(19(20(21,22)23)29-17(13)14)28-12-6-4-5-11(9-12)27-3/h4-9,25H,10H2,1-3H3InChIKey
DNDWQKHIXUNQCT-UHFFFAOYSA-NSynonyms
845653-36-38((DIMETHYLAMINO)METHYL)7HYDROXY3(3METHOXYPHENOXY)2(TRIFLUOROMETHYL)CHROMEN4ONE
8((dimethylammonio)methyl)3(3methoxyphenoxy)4oxo2(trifluoromethyl)4Hchromen7olate
8(DIMETHYLAMINOMETHYL)7HYDROXY3(3METHOXYPHENOXY)2(TRIFLUOROMETHYL)CHROMEN4ONE
845653363
CN(C)CC1=C(C=CC2=C1OC(=C(C2=O)OC3=CC(=CC=C3)OC)C(F)(F)F)O
COc1cccc(c1)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)C(NH+)(C)C)(O)
InChI=1SC20H18F3NO5c124(2)101415(25)871316(26)18(19(20(2122)23)2917(13)14)281264511(912)273h4925H10H213H3
MFCD04167993
ZINC000020649092
ZINC20649092
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