Chem
J-GLOBAL ID：201407046368256218   Nikkaji number：J3.301.845B

1-(2-Cyclooctyne-1-yl)-1H-pyrrole-2,5-dione

1-(2-シクロオクチン-1-イル)-1H-ピロール-2,5-ジオン
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： C12H13NO2
Molecular formula furigana： C12-H13-N-O2
Molecular weight： 203.241
InChI： InChI=1S/C12H13NO2/c14-11-8-9-12(15)13(11)10-6-4-2-1-3-5-7-10/h8-10H,1-4,6H2
InChI key： KCDJBFWZFSQBAQ-UHFFFAOYSA-N
SMILES： O=C1C=CC(=O)N1C1CCCCCC#C1
Systematic name  (3)：
  • 1-(2-シクロオクチン-1-イル)-1H-ピロール-2,5-ジオン
  • 1-(シクロオクタ-2-イン-1-イル)-2,5-ジヒドロ-1H-ピロール-2,5-ジオン
  • 1-(cyclooct-2-yn-1-yl)-2,5-dihydro-1H-pyrrole-2,5-dione
Other name (1)：
  • 1-(2-Cyclooctyne-1-yl)-1H-pyrrole-2,5-dione
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