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
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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:
C15 H16 N2 O3
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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