Chem
J-GLOBAL ID：200907036425114144   Nikkaji number：J2.176.833B

(3aS)-2-Benzyl-5α-(1-benzyl-2,5-dioxopyrrolidine-3-yl)-2,3,3aα,4,5,9bα-hexahydro-1H-benzo[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,4,5,9bα-ヘキサヒドロ-1H-ベンゾ[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： C30H26N2O4
Molecular formula furigana： C30-H26-N2-O4
Molecular weight： 478.548
InChI： InChI=1S/C30H26N2O4/c33-26-16-24(28(34)31(26)17-19-9-3-1-4-10-19)23-15-25-27(22-14-8-7-13-21(22)23)30(36)32(29(25)35)18-20-11-5-2-6-12-20/h1-14,23-25,27H,15-18H2/t23-,24?,25-,27+/m0/s1
InChI key： LIKDBYQJJAQDQR-SEURSRMOSA-N
SMILES： O=C1CC([C@H]2C[C@H]3[C@H](C(=O)N(Cc4ccccc4)C3=O)c3ccccc23)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,4,5,9bα-ヘキサヒドロ-1H-ベンゾ[e]イソインドール-1,3-ジオン
  • 3-[(3aS,5R,9bS)-2-ベンジル-1,3-ジオキソ-1H,2H,3H,3aH,4H,5H,9bH-ベンゾ[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,9bS)-2-benzyl-1,3-dioxo-1H,2H,3H,3aH,4H,5H,9bH-benzo[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,4,5,9bα-hexahydro-1H-benzo[e]isoindole-1,3-dione
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