Chem
J-GLOBAL ID：201407063753920090   Nikkaji number：J3.300.265C

(1R,2S,4R)-2-Formyl-2-(4-methoxybenzoyloxy)-7-azabicyclo[2.2.2]octa-5-ene-7-carboxylic acid phenyl ester

(1R,2S,4R)-2-ホルミル-2-(4-メトキシベンゾイルオキシ)-7-アザビシクロ[2.2.2]オクタ-5-エン-7-カルボン酸フェニル
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： C23H21NO6
Molecular formula furigana： C23-H21-N-O6
Molecular weight： 407.422
InChI： InChI=1S/C23H21NO6/c1-28-18-10-8-17(9-11-18)21(26)30-23(15-25)13-16-7-12-20(23)24(14-16)22(27)29-19-5-3-2-4-6-19/h2-12,15-16,20H,13-14H2,1H3/t16-,20+,23+/m0/s1
InChI key： PPVVPOWSZQKADK-LERMDLETSA-N
SMILES： COc1ccc(cc1)C(=O)O[C@]1(C[C@H]2CN([C@@H]1C=C2)C(=O)Oc1ccccc1)C=O
Systematic name  (3)：
  • (1R,2S,4R)-2-ホルミル-2-(4-メトキシベンゾイルオキシ)-7-アザビシクロ[2.2.2]オクタ-5-エン-7-カルボン酸フェニル
  • フェニル (1R,4R,7S)-7-ホルミル-7-(4-メトキシベンゾイルオキシ)-2-アザビシクロ[2.2.2]オクタ-5-エン-2-カルボキシラート
  • phenyl (1R,4R,7S)-7-formyl-7-(4-methoxybenzoyloxy)-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate
Other name (1)：
  • (1R,2S,4R)-2-Formyl-2-(4-methoxybenzoyloxy)-7-azabicyclo[2.2.2]octa-5-ene-7-carboxylic acid phenyl ester
Thsaurus map：
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