Chem
J-GLOBAL ID：201207055347785444   Nikkaji number：J3.008.571J

(1R,4R)-3α-Formyl-8-azabicyclo[2.2.2]octane-5-ene-2β,8-dicarboxylic acid 2-methyl 8-benzyl ester

(1R,4R)-3α-ホルミル-8-アザビシクロ[2.2.2]オクタン-5-エン-2β,8-ジカルボン酸2-メチル8-ベンジル
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： C18H19NO5
Molecular formula furigana： C18-H19-N-O5
Molecular weight： 329.352
InChI： InChI=1S/C18H19NO5/c1-23-17(21)16-13-7-8-15(14(16)10-20)19(9-13)18(22)24-11-12-5-3-2-4-6-12/h2-8,10,13-16H,9,11H2,1H3/t13-,14+,15+,16+/m0/s1
InChI key： BLACMVOJNPXXNQ-ZJIFWQFVSA-N
SMILES： COC(=O)[C@@H]1[C@@H]2CN([C@H](C=C2)[C@H]1C=O)C(=O)OCc1ccccc1
Systematic name  (3)：
  • (1R,4R)-3α-ホルミル-8-アザビシクロ[2.2.2]オクタン-5-エン-2β,8-ジカルボン酸2-メチル8-ベンジル
  • 2-ベンジル 5-メチル (1R,4R,5R,6S)-6-ホルミル-2-アザビシクロ[2.2.2]オクタ-7-エン-2,5-ジカルボキシラート
  • 2-benzyl 5-methyl (1R,4R,5R,6S)-6-formyl-2-azabicyclo[2.2.2]oct-7-ene-2,5-dicarboxylate
Other name (1)：
  • (1R,4R)-3α-Formyl-8-azabicyclo[2.2.2]octane-5-ene-2β,8-dicarboxylic acid 2-methyl 8-benzyl ester
Thsaurus map：
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