Chem
J-GLOBAL ID:200907087190577943   Nikkaji number:J377.360D

Caelestine A

カエレスチンA
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: C10H6BrNO3
Molecular formula furigana: C10-H6-BR-N-O3
Molecular weight: 268.066
InChI: InChI=1S/C10H6BrNO3/c11-5-1-2-6-7(3-5)12-8(10(14)15)4-9(6)13/h1-4H,(H,12,13)(H,14,15)
InChI key: DGJNOQNOMLMGQD-UHFFFAOYSA-N
SMILES: OC(=O)c1cc(=O)c2ccc(Br)cc2[nH]1
Systematic name  (4):
  • 7-ブロモ-1,4-ジヒドロ-4-オキソキノリン-2-カルボン酸
  • 4-オキソ-7-ブロモ-1,4-ジヒドロキノリン-2-カルボン酸
  • 7-ブロモ-4-オキソ-1,4-ジヒドロキノリン-2-カルボン酸
  • 7-bromo-4-oxo-1,4-dihydroquinoline-2-carboxylic acid
Other name (4):
  • 7-Bromo-1,4-dihydro-4-oxoquinoline-2-carboxylic acid
  • 4-Oxo-7-bromo-1,4-dihydroquinoline-2-carboxylic acid
  • カエレスチンA
  • Caelestine A
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