Chem
J-GLOBAL ID:200907041759583777   Nikkaji number:J872.066E

1,2,3,4,6,6aβ,9,10,10aβ,10bα-Decahydro-8-bromo-9α-methylpyrido[2,1-a]isoindole-10β-carboxylic acid ethyl ester

1,2,3,4,6,6aβ,9,10,10aβ,10bα-デカヒドロ-8-ブロモ-9α-メチルピリド[2,1-a]イソインドール-10β-カルボン酸エチル
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: C16H24BrNO2
Molecular formula furigana: C16-H24-BR-N-O2
Molecular weight: 342.277
InChI: InChI=1S/C16H24BrNO2/c1-3-20-16(19)14-10(2)12(17)8-11-9-18-7-5-4-6-13(18)15(11)14/h8,10-11,13-15H,3-7,9H2,1-2H3/t10-,11-,13+,14+,15-/m0/s1
InChI key: ZKBBJAAONOMRRN-ADNNSEGNSA-N
SMILES: CCOC(=O)[C@H]1[C@H]2[C@H](CN3CCCC[C@H]23)C=C(Br)[C@@H]1C
Systematic name  (3):
  • 1,2,3,4,6,6aβ,9,10,10aβ,10bα-デカヒドロ-8-ブロモ-9α-メチルピリド[2,1-a]イソインドール-10β-カルボン酸エチル
  • エチル (6aS,9R,10S,10aR,10bR)-8-ブロモ-9-メチル-1H,2H,3H,4H,6H,6aH,9H,10H,10aH,10bH-ピリド[2,1-a]イソインドール-10-カルボキシラート
  • ethyl (6aS,9R,10S,10aR,10bR)-8-bromo-9-methyl-1H,2H,3H,4H,6H,6aH,9H,10H,10aH,10bH-pyrido[2,1-a]isoindole-10-carboxylate
Other name (1):
  • 1,2,3,4,6,6aβ,9,10,10aβ,10bα-Decahydro-8-bromo-9α-methylpyrido[2,1-a]isoindole-10β-carboxylic acid ethyl ester
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