Vitas-M small molecule compound
(2E)-2-(3-bromo-4-methoxybenzylidene)-4,4-dimethyl-3-oxopentanenitrile
Catalog ID
STK460482
SMILES N#C/C(=C\c1ccc(c(c1)Br)OC)/C(=O)C(C)(C)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 C15H16BrNO2 MW 322.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16BrNO2/c1-15(2,3)14(18)11(9-17)7-10-5-6-13(19-4)12(16)8-10/h5-8H,1-4H3/b11-7+InChIKey
YAEOWQRTUSIGNI-YRNVUSSQSA-NSynonyms
(2E)2((3BROMO4METHOXYPHENYL)METHYLIDENE)44DIMETHYL3OXOPENTANENITRILE
(2E)2(22DIMETHYLPROPANOYL)3(3BROMO4METHOXYPHENYL)PROP2ENENITRILE
(2E)2(3bromo4methoxybenzylidene)44dimethyl3oxopentanenitrile
CC(C)(C)C(=O)C(=CC1=CC(=C(C=C1)OC)Br)C#N
InChI=1SC15H16BrNO2c115(23)14(18)11(917)7105613(194)12(16)810h58H14H3b117+
MFCD04248137
N#CC(=Cc1ccc(c(c1)Br)OC)C(=O)C(C)(C)C
ZINC000006823162
ZINC06823162
ZINC6823162
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