Vitas-M small molecule compound

(2E)-3-(3-ethoxy-4-methoxyphenyl)-1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)prop-2-en-1-one

Catalog ID
STL513530
SMILES CCOc1cc(/C=C/C(=O)c2c3CCN(Cc3c(c3c2OCO3)OC)C)ccc1OC

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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 C24H27NO6 MW 425.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO6/c1-5-29-20-12-15(7-9-19(20)27-3)6-8-18(26)21-16-10-11-25(2)13-17(16)22(28-4)24-23(21)30-14-31-24/h6-9,12H,5,10-11,13-14H2,1-4H3/b8-6+
InChIKey
QHXBXWGXNHOUKQ-SOFGYWHQSA-N
Synonyms
370583-59-8
(~(E))3(3ethoxy4methoxyphenyl)1(4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin9yl)prop2en1one
(2E)3(3ethoxy4methoxyphenyl)1(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)prop2en1one
(E)3(3ethoxy4methoxyphenyl)1(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)prop2en1one
(E)3(3ETHOXY4METHOXYPHENYL)1(4METHOXY6METHYL78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLIN9YL)PROP2EN1ONE
370583598
5915059
CCOc1cc(C=CC(=O)c2c3CCN(Cc3c(c3c2OCO3)OC)C)ccc1OC
InChI=1SC24H27NO6c1529201215(7919(20)273)6818(26)2116101125(2)1317(16)22(284)2423(21)30143124h6912H510111314H214H3b86+
MFCD03005928
ZINC000020112664
ZINC20112664

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Available files

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