Vitas-M small molecule compound
[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl 3-fluoro-4-methoxybenzoate
Catalog ID
STK900839
SMILES COc1ccc(cc1F)C(=O)OCc1onc(n1)c1ccc2c(c1)OCO2
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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 C18H13FN2O6 MW 372.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13FN2O6/c1-23-13-4-3-11(6-12(13)19)18(22)24-8-16-20-17(21-27-16)10-2-5-14-15(7-10)26-9-25-14/h2-7H,8-9H2,1H3InChIKey
KIPBAUYSYRLNCN-UHFFFAOYSA-NSynonyms
(3(13benzodioxol5yl)124oxadiazol5yl)methyl3fluoro4methoxybenzoate
COC1=C(C=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CC4=C(C=C3)OCO4)F
InChI=1SC18H13FN2O6c123134311(612(13)19)18(22)248162017(212716)10251415(710)2692514h27H89H21H3
MFCD18173655
ZINC000044836718
ZINC44836718
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