Vitas-M small molecule compound

3-(3-methoxyphenoxy)-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate

Catalog ID
STL050367
SMILES COc1cccc(c1)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+]1CCN(CC1)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 C23H23F3N2O5 MW 464.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23F3N2O5/c1-27-8-10-28(11-9-27)13-17-18(29)7-6-16-19(30)21(22(23(24,25)26)33-20(16)17)32-15-5-3-4-14(12-15)31-2/h3-7,12,29H,8-11,13H2,1-2H3
InChIKey
JTHWRZQJFRREFK-UHFFFAOYSA-N
Synonyms
845806-13-5
3(3methoxyphenoxy)8((4methylpiperazin1ium1yl)methyl)4oxo2(trifluoromethyl)4Hchromen7olate
COc1cccc(c1)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)C(NH+)1CCN(CC1)C)(O)

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Available files

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