Chem
J-GLOBAL ID:200907021122852102   Nikkaji number:J1.918.288F

Diacetic acid (1S,4R,7R,8S)-7,8-[(phenylimino)biscarbonyl]bicyclo[2.2.2]octa-5-ene-2β,3α-diyl ester

二酢酸(1S,4R,7R,8S)-7,8-[(フェニルイミノ)ビスカルボニル]ビシクロ[2.2.2]オクタ-5-エン-2β,3α-ジイル
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: C20H19NO6
Molecular formula furigana: C20-H19-N-O6
Molecular weight: 369.373
InChI: InChI=1S/C20H19NO6/c1-10(22)26-17-13-8-9-14(18(17)27-11(2)23)16-15(13)19(24)21(20(16)25)12-6-4-3-5-7-12/h3-9,13-18H,1-2H3/t13-,14+,15+,16-,17-,18-/m1/s1
InChI key: MWRMSTPHWYLEOU-GQLSEVEHSA-N
SMILES: CC(=O)O[C@H]1[C@H](OC(=O)C)[C@@H]2C=C[C@H]1[C@@H]1[C@H]2C(=O)N(C1=O)c1ccccc1
Systematic name  (3):
  • 二酢酸(1S,4R,7R,8S)-7,8-[(フェニルイミノ)ビスカルボニル]ビシクロ[2.2.2]オクタ-5-エン-2β,3α-ジイル
  • (1S,2R,6S,7R,8R,9R)-9-(アセチルオキシ)-3,5-ジオキソ-4-フェニル-4-アザトリシクロ[5.2.2.02,6]ウンデカ-10-エン-8-イル アセタート
  • (1S,2R,6S,7R,8R,9R)-9-(acetyloxy)-3,5-dioxo-4-phenyl-4-azatricyclo[5.2.2.02,6]undec-10-en-8-yl acetate
Other name (1):
  • Diacetic acid (1S,4R,7R,8S)-7,8-[(phenylimino)biscarbonyl]bicyclo[2.2.2]octa-5-ene-2β,3α-diyl ester
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