Chem
J-GLOBAL ID:200907032329582565   Nikkaji number:J351.716K

MDL-29951

2-カルボキシ-4,6-ジクロロ-1H-インドール-3-プロピオン酸
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: C12H9Cl2NO4
Molecular formula furigana: C12-H9-CL2-N-O4
Molecular weight: 302.110
InChI: InChI=1S/C12H9Cl2NO4/c13-5-3-7(14)10-6(1-2-9(16)17)11(12(18)19)15-8(10)4-5/h3-4,15H,1-2H2,(H,16,17)(H,18,19)
InChI key: KNBSYZNKEAWABY-UHFFFAOYSA-N
SMILES: OC(=O)CCc1c([nH]c2cc(Cl)cc(Cl)c12)C(=O)O
Systematic name  (4):
  • 3-(4,6-ジクロロ-2-カルボキシ-1H-インドール-3-イル)プロピオン酸
  • 2-カルボキシ-4,6-ジクロロ-1H-インドール-3-プロピオン酸
  • 3-(2-カルボキシエチル)-4,6-ジクロロ-1H-インドール-2-カルボン酸
  • 3-(2-carboxyethyl)-4,6-dichloro-1H-indole-2-carboxylic acid
Other name (2):
  • 2-Carboxy-4,6-dichloro-1H-indole-3-propionic acid
  • MDL-29951
CAS registry number: 130798-51-5
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