Chem
J-GLOBAL ID:200907001887114710   Nikkaji number:J376.213K

5,7-Di(benzyloxy)-2-[4-nitrophenyl]-4-oxo-4H-1-benzopyran-3-carboxylic acid methyl ester

4′-ニトロ-5,7-ジ(ベンジルオキシ)-3-(メトキシカルボニル)フラボン
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: C31H23[N+]O7[O-]
Molecular formula furigana: C31-H23-N-O8
Molecular weight: 537.524
InChI: InChI=1S/C31H23NO8/c1-37-31(34)28-29(33)27-25(39-19-21-10-6-3-7-11-21)16-24(38-18-20-8-4-2-5-9-20)17-26(27)40-30(28)22-12-14-23(15-13-22)32(35)36/h2-17H,18-19H2,1H3
InChI key: UDQCXEYRHMOALB-UHFFFAOYSA-N
SMILES: COC(=O)c1c(oc2cc(OCc3ccccc3)cc(OCc3ccccc3)c2c1=O)c1ccc(cc1)[N+](=O)[O-]
Systematic name  (4):
  • 4′-ニトロ-5,7-ジ(ベンジルオキシ)-3-(メトキシカルボニル)フラボン
  • 5,7-ジ(ベンジルオキシ)-2-[4-ニトロフェニル]-4-オキソ-4H-1-ベンゾピラン-3-カルボン酸メチル
  • メチル 5,7-ビス(ベンジルオキシ)-2-(4-ニトロフェニル)-4-オキソ-4H-クロメン-3-カルボキシラート
  • methyl 5,7-bis(benzyloxy)-2-(4-nitrophenyl)-4-oxo-4H-chromene-3-carboxylate
Other name (1):
  • 5,7-Di(benzyloxy)-2-[4-nitrophenyl]-4-oxo-4H-1-benzopyran-3-carboxylic acid methyl ester
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