Vitas-M small molecule compound

3-(4-chlorophenyl)-8-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate

Catalog ID
STL048343
SMILES OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(c(c2=O)c1ccc(cc1)Cl)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 C23H22ClF3N2O4 MW 482.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClF3N2O4/c24-15-3-1-14(2-4-15)19-20(32)16-5-6-18(31)17(21(16)33-22(19)23(25,26)27)13-29-9-7-28(8-10-29)11-12-30/h1-6,30-31H,7-13H2
InChIKey
OBBQPDZNWBFFIJ-UHFFFAOYSA-N
Synonyms
846062-69-9
3(4chlorophenyl)8((4(2hydroxyethyl)piperazin1ium1yl)methyl)4oxo2(trifluoromethyl)4Hchromen7olate
OCCN1CC(NH+)(CC1)Cc1c((O))ccc2c1oc(c(c2=O)c1ccc(cc1)Cl)C(F)(F)F

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Available files

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