Vitas-M small molecule compound
3-[(2E)-3-(1,3-benzodioxol-5-yl)-2-methylprop-2-enoyl]-4,6-dimethylpyridin-2(1H)-one
Catalog ID
STK374912
SMILES C/C(=C\c1ccc2c(c1)OCO2)/C(=O)c1c(C)cc([nH]c1=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 C18H17NO4 MW 311.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO4/c1-10-6-12(3)19-18(21)16(10)17(20)11(2)7-13-4-5-14-15(8-13)23-9-22-14/h4-8H,9H2,1-3H3,(H,19,21)/b11-7+InChIKey
GHHAPCLWRGLFMJ-YRNVUSSQSA-NSynonyms
3((2E)3(13benzodioxol5yl)2methylprop2enoyl)46dimethylpyridin2(1H)one
3((2E)3(2HBENZO(34D)13DIOXOLAN5YL)2METHYLPROP2ENOYL)46DIMETHYLHYDROPYRIDIN2ONE
3((E)3(13BENZODIOXOL5YL)2METHYLPROP2ENOYL)46DIMETHYL1HPYRIDIN2ONE
3(3BENZO(13)DIOXOL5YL2METHYLACRYLOYL)46DIMETHYL1HPYRIDIN2ONE
CC(=Cc1ccc2c(c1)OCO2)C(=O)c1c(C)cc((nH)c1=O)C
CC1=CC(=C(C(=O)N1)C(=O)C(=CC2=CC3=C(C=C2)OCO3)C)C
InChI=1SC18H17NO4c110612(3)1918(21)16(10)17(20)11(2)713451415(813)2392214h48H9H213H3(H1921)b117+
MFCD00852847
ZINC000004579697
ZINC04579697
ZINC4579697
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