Vitas-M small molecule compound
1-{[4-(ethoxycarbonyl)-2,2-dimethyl-5-oxo-2,5-dihydrofuran-3-yl]methyl}pyridinium
Catalog ID
STL058965
SMILES CCOC(=O)C1=C(C[n+]2ccccc2)C(OC1=O)(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 C15H18NO4 MW 276.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18NO4/c1-4-19-13(17)12-11(15(2,3)20-14(12)18)10-16-8-6-5-7-9-16/h5-9H,4,10H2,1-3H3/q+1InChIKey
SWIRUCTVYTUWMO-UHFFFAOYSA-NSynonyms
1((4(ethoxycarbonyl)22dimethyl5oxo25dihydrofuran3yl)methyl)pyridin1iumiodide
1((4(ethoxycarbonyl)22dimethyl5oxo25dihydrofuran3yl)methyl)pyridinium
1(4ETHOXYCARBONYL22DIMETHYL5OXO25DIHYDROFURAN3YLMETHYL)PYRIDINIUM
CCOC(=O)C1=C(C(n+)2ccccc2)C(OC1=O)(C)C
CCOC(=O)C1=C(C(n+)2ccccc2)C(OC1=O)(C)C(I)
CCOC(=O)C1=C(C(OC1=O)(C)C)C(N+)2=CC=CC=C2
ETHYL55DIMETHYL2OXO4(PYRIDIN1IUM1YLMETHYL)FURAN3CARBOXYLATE
ETHYL55DIMETHYL2OXO4(PYRIDYLMETHYL)5HYDROFURAN3CARBOXYLATE
InChI=1SC15H18NO4c141913(17)1211(15(23)2014(12)18)10168657916h59H410H213H3q+1
ZINC000004610646
ZINC04610646
ZINC4610646
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