Vitas-M small molecule compound

4-{[4-(ethoxycarbonyl)piperazin-1-ium-1-yl]methyl}-7-methyl-2-oxo-2H-chromen-6-olate

Catalog ID
STL516048
SMILES CCOC(=O)N1CC[NH+](CC1)Cc1cc(=O)oc2c1cc([O-])c(c2)C

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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 C18H22N2O5 MW 346.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O5/c1-3-24-18(23)20-6-4-19(5-7-20)11-13-9-17(22)25-16-8-12(2)15(21)10-14(13)16/h8-10,21H,3-7,11H2,1-2H3
InChIKey
VZAKAABPZFSIIY-UHFFFAOYSA-N
Synonyms
859859-66-8
4((4(ethoxycarbonyl)piperazin1ium1yl)methyl)7methyl2oxo2Hchromen6olate
44664626
859859668
MFCD05672964
ZINC000020412471

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.