Vitas-M small molecule compound
(2Z)-7-{[butyl(methyl)ammonio]methyl}-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK620657
SMILES CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O)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 C23H24ClNO5 MW 429.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24ClNO5/c1-3-4-7-25(2)11-18-19(26)6-5-17-21(27)20(30-23(17)18)10-14-8-16(24)9-15-12-28-13-29-22(14)15/h5-6,8-10,26H,3-4,7,11-13H2,1-2H3/b20-10-InChIKey
DYJHEECXHLSXDY-JMIUGGIZSA-NSynonyms
929398-31-2(2Z)7((butyl(methyl)ammonio)methyl)2((6chloro4H13benzodioxin8yl)methylidene)3oxo23dihydro1benzofuran6olate
7((BUTYLMETHYLAMINO)METHYL)2((6CHLORO(2H4HBENZO(E)13DIOXIN8YL))METHYLENE)6HYDROXYBENZO(B)FURAN3ONE
CCCC(NH+)(Cc1c((O))ccc2c1OC(=Cc1cc(Cl)cc3c1OCOC3)C2=O)C
MFCD09792510
ZINC000013655964
ZINC13655964
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