Vitas-M small molecule compound
2-(ethoxycarbonyl)-6-ethyl-3-(1-methyl-1H-benzimidazol-1-ium-2-yl)-4-oxo-4H-chromen-7-olate
Catalog ID
STL528546
SMILES CCOC(=O)c1oc2cc([O-])c(cc2c(=O)c1C1=Nc2c([NH+]1C)cccc2)CC
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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 C22H20N2O5 MW 392.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O5/c1-4-12-10-13-17(11-16(12)25)29-20(22(27)28-5-2)18(19(13)26)21-23-14-8-6-7-9-15(14)24(21)3/h6-11,25H,4-5H2,1-3H3InChIKey
YVNQUFRHKLCEBL-UHFFFAOYSA-NSynonyms
610758-26-41426699
2(ethoxycarbonyl)6ethyl3(1methyl1Hbenzimidazol1ium2yl)4oxo4Hchromen7olate
2ethoxycarbonyl6ethyl3(1methyl1~(H)benzimidazol1ium2yl)4oxochromen7olate
610758264
MFCD00711433
ZINC000005625530
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