Vitas-M small molecule compound

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

Catalog ID
STL052009
SMILES CCCOC(=O)c1ccc(cc1)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 C26H27F3N2O6 MW 520.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27F3N2O6/c1-3-14-35-25(34)16-4-6-17(7-5-16)36-23-21(33)18-8-9-20(32)19(15-31-12-10-30(2)11-13-31)22(18)37-24(23)26(27,28)29/h4-9,32H,3,10-15H2,1-2H3
InChIKey
LESULNFNEWFHBY-UHFFFAOYSA-N
Synonyms
848689-69-0
8((4methylpiperazin1ium1yl)methyl)4oxo3(4(propoxycarbonyl)phenoxy)2(trifluoromethyl)4Hchromen7olate
CCCOC(=O)c1ccc(cc1)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)C(NH+)1CCN(CC1)C)(O)

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Available files

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