Vitas-M small molecule compound
(2Z)-2-[4-(methoxycarbonyl)benzylidene]-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STL519804
SMILES COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCOCC1)[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 C22H21NO6 MW 395.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO6/c1-27-22(26)15-4-2-14(3-5-15)12-19-20(25)16-6-7-18(24)17(21(16)29-19)13-23-8-10-28-11-9-23/h2-7,12,24H,8-11,13H2,1H3/b19-12-InChIKey
ZMGASYMGJSMVHC-UNOMPAQXSA-NSynonyms
869078-19-3(2~(Z))2((4methoxycarbonylphenyl)methylidene)7(morpholin4ium4ylmethyl)3oxo1benzofuran6olate
(2Z)2(4(methoxycarbonyl)benzylidene)7(morpholin4ium4ylmethyl)3oxo23dihydro1benzofuran6olate
53229833
869078193
MFCD06405786
ZINC000022625759
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