Vitas-M small molecule compound
(2E)-3-(7-methoxy-1,3-benzodioxol-5-yl)-2-(3,4,5-trimethoxyphenyl)prop-2-enenitrile
Catalog ID
STL433576
SMILES N#C/C(=C/c1cc(OC)c2c(c1)OCO2)/c1cc(OC)c(c(c1)OC)OC
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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 C20H19NO6 MW 369.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO6/c1-22-15-6-12(7-18-20(15)27-11-26-18)5-14(10-21)13-8-16(23-2)19(25-4)17(9-13)24-3/h5-9H,11H2,1-4H3/b14-5-InChIKey
DBEOZXYRHRZKBJ-RZNTYIFUSA-NSynonyms
(2E)3(7methoxy13benzodioxol5yl)2(345trimethoxyphenyl)prop2enenitrile
(E)3(7methoxy13benzodioxol5yl)2(345trimethoxyphenyl)prop2enenitrile
COC1=CC(=CC2=C1OCO2)C=C(C#N)C3=CC(=C(C(=C3)OC)OC)OC
InChI=1SC20H19NO6c12215612(71820(15)27112618)514(1021)13816(232)19(254)17(913)243h59H11H214H3b145
MFCD30711122
N#CC(=Cc1cc(OC)c2c(c1)OCO2)c1cc(OC)c(c(c1)OC)OC
ZINC000096137282
ZINC96137282
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