Chem
J-GLOBAL ID：200907053536642109   Nikkaji number：J1.715.039A

(6-Nitro-3-formyl-1H-indole-2-yl)malonic acid dimethyl ester

(6-ニトロ-3-ホルミル-1H-インドール-2-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： C14H12N[N+]O6[O-]
Molecular formula furigana： C14-H12-N2-O7
Molecular weight： 320.257
InChI： InChI=1S/C14H12N2O7/c1-22-13(18)11(14(19)23-2)12-9(6-17)8-4-3-7(16(20)21)5-10(8)15-12/h3-6,11,15H,1-2H3
InChI key： MLYZJXLLYRLHRP-UHFFFAOYSA-N
SMILES： COC(=O)C(C(=O)OC)c1[nH]c2cc(ccc2c1C=O)[N+](=O)[O-]
Systematic name  (4)：
  • 2-(3-ホルミル-6-ニトロ-1H-インドール-2-イル)マロン酸ジメチル
  • (6-ニトロ-3-ホルミル-1H-インドール-2-イル)マロン酸ジメチル
  • 1,3-ジメチル 2-(3-ホルミル-6-ニトロ-1H-インドール-2-イル)プロパンジオアート
  • 1,3-dimethyl 2-(3-formyl-6-nitro-1H-indol-2-yl)propanedioate
Other name (2)：
  • 2-(3-Formyl-6-nitro-1H-indole-2-yl)malonic acid dimethyl ester
  • (6-Nitro-3-formyl-1H-indole-2-yl)malonic acid dimethyl ester
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