Chem
J-GLOBAL ID：200907022606798630   Nikkaji number：J2.176.835I

(3aS)-2-Benzyl-5α-(1-benzyl-2,5-dioxopyrrolidine-3-yl)-2,3,3aα,4,5,11bα-hexahydro-1H-naphtho[2,3-e]isoindole-1,3-dione

(3aS)-2-ベンジル-5α-(1-ベンジル-2,5-ジオキソピロリジン-3-イル)-2,3,3aα,4,5,11bα-ヘキサヒドロ-1H-ナフト[2,3-e]イソインドール-1,3-ジオン
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： C34H28N2O4
Molecular formula furigana： C34-H28-N2-O4
Molecular weight： 528.608
InChI： InChI=1S/C34H28N2O4/c37-30-18-28(32(38)35(30)19-21-9-3-1-4-10-21)26-17-29-31(27-16-24-14-8-7-13-23(24)15-25(26)27)34(40)36(33(29)39)20-22-11-5-2-6-12-22/h1-16,26,28-29,31H,17-20H2/t26-,28?,29-,31+/m0/s1
InChI key： MAFUIVAQOIMZLJ-RPPRSIJFSA-N
SMILES： O=C1CC([C@H]2C[C@H]3[C@H](C(=O)N(Cc4ccccc4)C3=O)c3cc4ccccc4cc23)C(=O)N1Cc1ccccc1
Systematic name  (3)：
  • (3aS)-2-ベンジル-5α-(1-ベンジル-2,5-ジオキソピロリジン-3-イル)-2,3,3aα,4,5,11bα-ヘキサヒドロ-1H-ナフト[2,3-e]イソインドール-1,3-ジオン
  • 3-[(3aS,5R,11bS)-2-ベンジル-1,3-ジオキソ-1H,2H,3H,3aH,4H,5H,11bH-ナフト[2,3-e]イソインドール-5-イル]-1-ベンジルピロリジン-2,5-ジオン
  • 3-[(3aS,5R,11bS)-2-benzyl-1,3-dioxo-1H,2H,3H,3aH,4H,5H,11bH-naphtho[2,3-e]isoindol-5-yl]-1-benzylpyrrolidine-2,5-dione
Other name (1)：
  • (3aS)-2-Benzyl-5α-(1-benzyl-2,5-dioxopyrrolidine-3-yl)-2,3,3aα,4,5,11bα-hexahydro-1H-naphtho[2,3-e]isoindole-1,3-dione
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