Chem
J-GLOBAL ID:200907012188485543   Nikkaji number:J702.069D

1,2,3,5,6,9,10,10aα-Octahydro-6,9-dioxo-7-methoxy-8-methylpyrrolo[1,2-b]isoquinoline-3α-carbonitrile

1,2,3,5,6,9,10,10aα-オクタヒドロ-6,9-ジオキソ-7-メトキシ-8-メチルピロロ[1,2-b]イソキノリン-3α-カルボニトリル
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: C15H16N2O3
Molecular formula furigana: C15-H16-N2-O3
Molecular weight: 272.304
InChI: InChI=1S/C15H16N2O3/c1-8-13(18)11-5-9-3-4-10(6-16)17(9)7-12(11)14(19)15(8)20-2/h9-10H,3-5,7H2,1-2H3/t9-,10-/m1/s1
InChI key: WDKAZGQRTYKAPP-NXEZZACHSA-N
SMILES: COC1=C(C)C(=O)C2=C(CN3[C@H](CC[C@@H]3C#N)C2)C1=O
Systematic name  (3):
  • 1,2,3,5,6,9,10,10aα-オクタヒドロ-6,9-ジオキソ-7-メトキシ-8-メチルピロロ[1,2-b]イソキノリン-3α-カルボニトリル
  • (3R,10aR)-7-メトキシ-8-メチル-6,9-ジオキソ-1H,2H,3H,5H,6H,9H,10H,10aH-ピロロ[1,2-b]イソキノリン-3-カルボニトリル
  • (3R,10aR)-7-methoxy-8-methyl-6,9-dioxo-1H,2H,3H,5H,6H,9H,10H,10aH-pyrrolo[1,2-b]isoquinoline-3-carbonitrile
Other name (1):
  • 1,2,3,5,6,9,10,10aα-Octahydro-6,9-dioxo-7-methoxy-8-methylpyrrolo[1,2-b]isoquinoline-3α-carbonitrile
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