Vitas-M small molecule compound
(2E)-3-(7-methoxy-1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)prop-2-enenitrile
Catalog ID
STL433575
SMILES COc1ccc(cc1)/C(=C\c1cc(OC)c2c(c1)OCO2)/C#N
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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 C18H15NO4 MW 309.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15NO4/c1-20-15-5-3-13(4-6-15)14(10-19)7-12-8-16(21-2)18-17(9-12)22-11-23-18/h3-9H,11H2,1-2H3/b14-7-InChIKey
OBVONWNQCSVRAT-AUWJEWJLSA-NSynonyms
(2E)3(7methoxy13benzodioxol5yl)2(4methoxyphenyl)prop2enenitrile
(E)3(7methoxy13benzodioxol5yl)2(4methoxyphenyl)prop2enenitrile
COC1=CC=C(C=C1)C(=CC2=CC3=C(C(=C2)OC)OCO3)C#N
COc1ccc(cc1)C(=Cc1cc(OC)c2c(c1)OCO2)C#N
InChI=1SC18H15NO4c120155313(4615)14(1019)712816(212)1817(912)22112318h39H11H212H3b147
MFCD30711121
ZINC000096137280
ZINC96137280
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