Vitas-M small molecule compound
3-(7-methoxy-1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-3-oxopropanenitrile
Catalog ID
STL433463
SMILES COc1ccc(cc1)C(C(=O)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 C18H15NO5 MW 325.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15NO5/c1-21-13-5-3-11(4-6-13)14(9-19)17(20)12-7-15(22-2)18-16(8-12)23-10-24-18/h3-8,14H,10H2,1-2H3InChIKey
KJYNNLFVAYHMAZ-UHFFFAOYSA-NSynonyms
3(7methoxy13benzodioxol5yl)2(4methoxyphenyl)3oxopropanenitrile
3(7METHOXY2H13BENZODIOXOL5YL)2(4METHOXYPHENYL)3OXOPROPANENITRILE
COC1=CC=C(C=C1)C(C#N)C(=O)C2=CC3=C(C(=C2)OC)OCO3
InChI=1SC18H15NO5c121135311(4613)14(919)17(20)12715(222)1816(812)23102418h3814H10H212H3
MFCD25975865
ZINC000066089822
ZINC000066089823
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