Chem
J-GLOBAL ID：200907021225708441   Nikkaji number：J2.560.168H

[6-[(E)-4-(Dimethylamino)styryl]-2-oxo-3-cyano-2H-pyran-4-yl]malonic acid dimethyl ester

[6-[(E)-4-(ジメチルアミノ)スチリル]-2-オキソ-3-シアノ-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/b10-7+
InChI key： NPHMYKAPJVOOLD-JXMROGBWSA-N
SMILES： COC(=O)C(C(=O)OC)c1cc(/C=C/c2ccc(cc2)N(C)C)oc(=O)c1C#N
Systematic name  (3)：
  • [6-[(E)-4-(ジメチルアミノ)スチリル]-2-オキソ-3-シアノ-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-[(1E)-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-[(1E)-2-[4-(dimethylamino)phenyl]ethenyl]-2-oxo-2H-pyran-4-yl}propanedioate
Other name (1)：
  • [6-[(E)-4-(Dimethylamino)styryl]-2-oxo-3-cyano-2H-pyran-4-yl]malonic acid dimethyl ester
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