Chem
J-GLOBAL ID：200907057962484052   Nikkaji number：J2.319.420A

[2-Oxo-3-cyano-6-[4-(dimethylamino)styryl]-2H-pyran-4-yl]malonic acid dimethyl ester

[2-オキソ-3-シアノ-6-[4-(ジメチルアミノ)スチリル]-2H-ピラン-4-イル]マロン酸ジメチル
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C21H20N2O6
Molecular formula furigana： C21-H20-N2-O6
Molecular weight： 396.399
InChI： InChI=1S/C21H20N2O6/c1-23(2)14-8-5-13(6-9-14)7-10-15-11-16(17(12-22)19(24)29-15)18(20(25)27-3)21(26)28-4/h5-11,18H,1-4H3
InChI key： NPHMYKAPJVOOLD-UHFFFAOYSA-N
SMILES： COC(=O)C(C(=O)OC)c1cc(C=Cc2ccc(cc2)N(C)C)oc(=O)c1C#N
Systematic name  (3)：
  • [2-オキソ-3-シアノ-6-[4-(ジメチルアミノ)スチリル]-2H-ピラン-4-イル]マロン酸ジメチル
  • 1,3-ジメチル 2-(3-シアノ-6-{2-[4-(ジメチルアミノ)フェニル]エテニル}-2-オキソ-2H-ピラン-4-イル)プロパンジオアート
  • 1,3-dimethyl 2-(3-cyano-6-{2-[4-(dimethylamino)phenyl]ethenyl}-2-oxo-2H-pyran-4-yl)propanedioate
Other name (1)：
  • [2-Oxo-3-cyano-6-[4-(dimethylamino)styryl]-2H-pyran-4-yl]malonic acid dimethyl ester
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