Chem
J-GLOBAL ID：200907030852136762   Nikkaji number：J1.692.736H

(1S,3S,6R,10S)-9-[(Z)-(5-Methyl-2-thienyl)methylene]-7-azatricyclo[4.3.1.03,7]decane-10-carboxylic acid methyl ester

(1S,3S,6R,10S)-9-[(Z)-(5-メチル-2-チエニル)メチレン]-7-アザトリシクロ[4.3.1.03,7]デカン-10-カルボン酸メチル
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： C17H21NO2S
Molecular formula furigana： C17-H21-N-O2-S
Molecular weight： 303.420
InChI： InChI=1S/C17H21NO2S/c1-10-3-5-13(21-10)7-11-9-18-12-4-6-15(18)16(14(11)8-12)17(19)20-2/h3,5,7,12,14-16H,4,6,8-9H2,1-2H3/b11-7+/t12-,14+,15+,16-/m0/s1
InChI key： UPWOCOQLXHPHGS-GRDPYUQISA-N
SMILES： COC(=O)[C@@H]1[C@H]2CC[C@H]3C[C@@H]1/C(=C/c1ccc(C)s1)/CN23
Systematic name  (3)：
  • (1S,3S,6R,10S)-9-[(Z)-(5-メチル-2-チエニル)メチレン]-7-アザトリシクロ[4.3.1.03,7]デカン-10-カルボン酸メチル
  • メチル (1S,2S,3R,6S,9Z)-9-[(5-メチルチオフェン-2-イル)メチリデン]-7-アザトリシクロ[4.3.1.03,7]デカン-2-カルボキシラート
  • methyl (1S,2S,3R,6S,9Z)-9-[(5-methylthiophen-2-yl)methylidene]-7-azatricyclo[4.3.1.03,7]decane-2-carboxylate
Other name (1)：
  • (1S,3S,6R,10S)-9-[(Z)-(5-Methyl-2-thienyl)methylene]-7-azatricyclo[4.3.1.03,7]decane-10-carboxylic acid methyl ester
Thsaurus map：
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