Chem
J-GLOBAL ID:200907051034873023   Nikkaji number:J1.319.285E

2-[2-[[(3aR,9bR)-6-Methoxy-2,3,3a,4,5,9b-hexahydro-1H-benzo[e]isoindole]-2-yl]ethyl]-6-methoxy-2,4,5-triaza-9H-fluorene-1,3(2H,4H)-dione

2-[2-[[(3aR,9bR)-6-メトキシ-2,3,3a,4,5,9b-ヘキサヒドロ-1H-ベンゾ[e]イソインドール]-2-イル]エチル]-6-メトキシ-2,4,5-トリアザ-9H-フルオレン-1,3(2H,4H)-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: C26H28N4O4
Molecular formula furigana: C26-H28-N4-O4
Molecular weight: 460.534
InChI: InChI=1S/C26H28N4O4/c1-33-21-5-3-4-17-18(21)8-6-16-13-29(14-20(16)17)10-11-30-25(31)19-12-15-7-9-22(34-2)27-23(15)24(19)28-26(30)32/h3-5,7,9,16,20H,6,8,10-14H2,1-2H3,(H,28,32)/t16-,20+/m0/s1
InChI key: FKFOBQQXGZWKFW-OXJNMPFZSA-N
SMILES: COc1ccc2Cc3c([nH]c(=O)n(CCN4C[C@@H]5CCc6c(OC)cccc6[C@@H]5C4)c3=O)c2n1
Systematic name  (3):
  • 2-[2-[[(3aR,9bR)-6-メトキシ-2,3,3a,4,5,9b-ヘキサヒドロ-1H-ベンゾ[e]イソインドール]-2-イル]エチル]-6-メトキシ-2,4,5-トリアザ-9H-フルオレン-1,3(2H,4H)-ジオン
  • 5-{2-[(3aR,9bR)-6-メトキシ-1H,2H,3H,3aH,4H,5H,9bH-ベンゾ[e]イソインドール-2-イル]エチル}-12-メトキシ-3,5,13-トリアザトリシクロ[7.4.0.02,7]トリデカ-1(13),2(7),9,11-テトラエン-4,6-ジオン
  • 5-{2-[(3aR,9bR)-6-methoxy-1H,2H,3H,3aH,4H,5H,9bH-benzo[e]isoindol-2-yl]ethyl}-12-methoxy-3,5,13-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),9,11-tetraene-4,6-dione
Other name (1):
  • 2-[2-[[(3aR,9bR)-6-Methoxy-2,3,3a,4,5,9b-hexahydro-1H-benzo[e]isoindole]-2-yl]ethyl]-6-methoxy-2,4,5-triaza-9H-fluorene-1,3(2H,4H)-dione
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