Chem
J-GLOBAL ID：201507006422327920   Nikkaji number：J3.426.029J

(R)-1-(2,4-Dinitrophenyl)-3-amyl-4-oxopentane-3-carboxylic acid ethyl ester

エチル (2R)-2-アセチル-2-[2-(2,4-ジニトロフェニル)エチル]ヘプタノアート
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： C19H26[N+]2O5[O-]2
Molecular formula furigana： C19-H26-N2-O7
Molecular weight： 394.424
InChI： InChI=1S/C19H26N2O7/c1-4-6-7-11-19(14(3)22,18(23)28-5-2)12-10-15-8-9-16(20(24)25)13-17(15)21(26)27/h8-9,13H,4-7,10-12H2,1-3H3/t19-/m1/s1
InChI key： NSRSYWRNCKAHFM-LJQANCHMSA-N
SMILES： CCCCC[C@@](CCc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])(C(=O)C)C(=O)OCC
Systematic name  (3)：
  • (R)-1-(2,4-ジニトロフェニル)-3-アミル-4-オキソペンタン-3-カルボン酸エチル
  • エチル (2R)-2-アセチル-2-[2-(2,4-ジニトロフェニル)エチル]ヘプタノアート
  • ethyl (2R)-2-acetyl-2-[2-(2,4-dinitrophenyl)ethyl]heptanoate
Other name (1)：
  • (R)-1-(2,4-Dinitrophenyl)-3-amyl-4-oxopentane-3-carboxylic acid ethyl ester
Thsaurus map：
Thesaurus Map

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