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-(3-methoxyphenyl)prop-2-en-1-one
Catalog ID
STL513620
SMILES COc1cccc(c1)/C=C/C(=O)c1c2CCN(Cc2c(c2c1OCO2)OC)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 C22H23NO5 MW 381.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO5/c1-23-10-9-16-17(12-23)20(26-3)22-21(27-13-28-22)19(16)18(24)8-7-14-5-4-6-15(11-14)25-2/h4-8,11H,9-10,12-13H2,1-3H3/b8-7+InChIKey
BUWJLRIUMCZMTR-BQYQJAHWSA-NSynonyms
1383425-76-0(~(E))1(4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin9yl)3(3methoxyphenyl)prop2en1one
(2E)1(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)3(3methoxyphenyl)prop2en1one
(E)1(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)3(3methoxyphenyl)prop2en1one
(E)1(4METHOXY6METHYL78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLIN9YL)3(3METHOXYPHENYL)PROP2EN1ONE
1383425760
6109780
COc1cccc(c1)C=CC(=O)c1c2CCN(Cc2c(c2c1OCO2)OC)C
InChI=1SC22H23NO5c1231091617(1223)20(263)2221(27132822)19(16)18(24)871454615(1114)252h4811H9101213H213H3b87+
MFCD03006211
ZINC000020112803
ZINC20112803
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