Vitas-M small molecule compound
(2Z)-5-[(dimethylammonio)methyl]-2-(4-methoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STL518639
SMILES COc1ccc(cc1)/C=C/1\Oc2c(C1=O)cc(c(c2C)[O-])C[NH+](C)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 C20H21NO4 MW 339.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO4/c1-12-18(22)14(11-21(2)3)10-16-19(23)17(25-20(12)16)9-13-5-7-15(24-4)8-6-13/h5-10,22H,11H2,1-4H3/b17-9-InChIKey
CTPNAINTXXXPGL-MFOYZWKCSA-NSynonyms
929452-15-3(2~(Z))5((dimethylazaniumyl)methyl)2((4methoxyphenyl)methylidene)7methyl3oxo1benzofuran6olate
(2Z)5((dimethylammonio)methyl)2(4methoxybenzylidene)7methyl3oxo23dihydro1benzofuran6olate
16422068
929452153
MFCD08742985
ZINC000020759720
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