Chem
J-GLOBAL ID：200907013726401939   Nikkaji number：J1.505.146I

4-[(6,11-Dihydro-8-chloro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine)-11-ylidene](2,2,6,6-2H4)piperidine-1-carboxylic acid ethyl ester

4-[(6,11-ジヒドロ-8-クロロ-5H-ベンゾ[5,6]シクロヘプタ[1,2-b]ピリジン)-11-イリデン](2,2,6,6-2H4)ピペリジン-1-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： C22H19[2H]4ClN2O2
Molecular formula furigana： C22-H23-CL-N2-O2
Molecular weight： 386.910
InChI： InChI=1S/C22H23ClN2O2/c1-2-27-22(26)25-12-9-15(10-13-25)20-19-8-7-18(23)14-17(19)6-5-16-4-3-11-24-21(16)20/h3-4,7-8,11,14H,2,5-6,9-10,12-13H2,1H3/i12D2,13D2
InChI key： JCCNYMKQOSZNPW-IDPVZSQYSA-N
SMILES： C1([2H])([2H])CC(=C2c3ccc(Cl)cc3CCc3cccnc23)CC([2H])([2H])N1C(=O)OCC
Systematic name  (3)：
  • 4-[(6,11-ジヒドロ-8-クロロ-5H-ベンゾ[5,6]シクロヘプタ[1,2-b]ピリジン)-11-イリデン](2,2,6,6-2H4)ピペリジン-1-カルボン酸エチル
  • エチル 4-{13-クロロ-4-アザトリシクロ[9.4.0.03,8]ペンタデカ-1(15),3,5,7,11,13-ヘキサエン-2-イリデン}(2,2,6,6-2H4)ピペリジン-1-カルボキシラート
  • ethyl 4-{13-chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-2-ylidene}(2,2,6,6-2H4)piperidine-1-carboxylate
Other name (1)：
  • 4-[(6,11-Dihydro-8-chloro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine)-11-ylidene](2,2,6,6-2H4)piperidine-1-carboxylic acid ethyl ester
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