Vitas-M small molecule compound
(2E)-1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)-3-(4-methylphenyl)prop-2-en-1-one
Catalog ID
STL513611
SMILES COc1c2CN(C)CCc2c(c2c1OCO2)C(=O)/C=C/c1ccc(cc1)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 C22H23NO4 MW 365.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO4/c1-14-4-6-15(7-5-14)8-9-18(24)19-16-10-11-23(2)12-17(16)20(25-3)22-21(19)26-13-27-22/h4-9H,10-13H2,1-3H3/b9-8+InChIKey
GJNZTNYOBNYMLN-CMDGGOBGSA-NSynonyms
370585-19-6(~(E))1(4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin9yl)3(4methylphenyl)prop2en1one
(2E)1(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)3(4methylphenyl)prop2en1one
(E)1(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)3(ptolyl)prop2en1one
(E)1(4METHOXY6METHYL78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLIN9YL)3(4METHYLPHENYL)PROP2EN1ONE
370585196
5913965
COc1c2CN(C)CCc2c(c2c1OCO2)C(=O)C=Cc1ccc(cc1)C
InChI=1SC22H23NO4c1144615(7514)8918(24)1916101123(2)1217(16)20(253)2221(19)26132722h49H1013H213H3b98+
MFCD03006346
ZINC000020112908
ZINC20112908
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