Chem
J-GLOBAL ID:200907050836452744   Nikkaji number:J668.403C

1,3-Dioxo-5-carboxyisoindoline-2-butyric acid

1,3-ジオキソ-5-カルボキシイソインドリン-2-酪酸
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: C13H11NO6
Molecular formula furigana: C13-H11-N-O6
Molecular weight: 277.232
InChI: InChI=1S/C13H11NO6/c15-10(16)2-1-5-14-11(17)8-4-3-7(13(19)20)6-9(8)12(14)18/h3-4,6H,1-2,5H2,(H,15,16)(H,19,20)
InChI key: BZPBNBIIOBUSRW-UHFFFAOYSA-N
SMILES: OC(=O)CCCN1C(=O)c2ccc(cc2C1=O)C(=O)O
Systematic name  (5):
  • 1,3-ジオキソ-5-カルボキシイソインドリン-2-酪酸
  • 1,3-ジオキソ-5-カルボキシ-1,3-ジヒドロ-2H-イソインドール-2-酪酸
  • 1,3-ジオキソ-2-(3-カルボキシプロピル)イソインドリン-5-カルボン酸
  • 2-(3-カルボキシプロピル)-1,3-ジオキソ-2,3-ジヒドロ-1H-イソインドール-5-カルボン酸
  • 2-(3-carboxypropyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Other name (3):
  • 1,3-Dioxo-5-carboxyisoindoline-2-butyric acid
  • 1,3-Dioxo-5-carboxy-1,3-dihydro-2H-isoindole-2-butyric acid
  • 1,3-Dioxo-2-(3-carboxypropyl)isoindoline-5-carboxylic acid
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