Chem
J-GLOBAL ID：200907038676719749   Nikkaji number：J2.176.836G

(3aS)-2-Benzyl-5α-(1-benzyl-2,5-dioxopyrrolidine-3-yl)-5-methyl-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)-5-メチル-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： C31H28N2O4
Molecular formula furigana： C31-H28-N2-O4
Molecular weight： 492.575
InChI： InChI=1S/C31H28N2O4/c1-31(25-16-26(34)32(29(25)36)18-20-10-4-2-5-11-20)17-23-27(22-14-8-9-15-24(22)31)30(37)33(28(23)35)19-21-12-6-3-7-13-21/h2-15,23,25,27H,16-19H2,1H3/t23-,25?,27+,31-/m0/s1
InChI key： UCGARYNJPNZGEH-LLTBVWDISA-N
SMILES： C[C@@]1(C[C@H]2[C@H](C(=O)N(Cc3ccccc3)C2=O)c2ccccc12)C1CC(=O)N(Cc2ccccc2)C1=O
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)-5-メチル-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-5-メチル-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-5-methyl-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)-5-methyl-2,3,3aα,4,5,9bα-hexahydro-1H-benzo[e]isoindole-1,3-dione
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