Chem
J-GLOBAL ID:200907016569241557   Nikkaji number:J963.324C

5,8,21,24-Tetrabenzyl-5,8,21,24-tetraazatricyclo[26.4.0.012,17]dotriacontane-1(28),12(17),13,15,29,31-hexene-2,10,18,26-tetryne

5,8,21,24-テトラベンジル-5,8,21,24-テトラアザトリシクロ[26.4.0.012,17]ドトリアコンタ-1(32),12,14,16,28,30-ヘキサエン-2,10,18,26-テトライン
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: C56H52N4
Molecular formula furigana: C56-H52-N4
Molecular weight: 781.060
InChI: InChI=1S/C56H52N4/c1-5-21-49(22-6-1)45-57-37-17-33-53-29-13-14-30-54(53)35-19-39-59(47-51-25-9-3-10-26-51)43-44-60(48-52-27-11-4-12-28-52)40-20-36-56-32-16-15-31-55(56)34-18-38-58(42-41-57)46-50-23-7-2-8-24-50/h1-16,21-32H,37-48H2
InChI key: DALNJNYUZKHGMY-UHFFFAOYSA-N
SMILES: C(N1CCN(Cc2ccccc2)CC#Cc2ccccc2C#CCN(Cc2ccccc2)CCN(Cc2ccccc2)CC#Cc2ccccc2C#CC1)c1ccccc1
Systematic name  (4):
  • 8,11,22,25-テトラベンジル-7,8,9,10,11,12,21,22,23,24,25,26-ドデカヒドロ-5,6,13,14,19,20,27,28-オクタデヒドロ-8,11,22,25-テトラアザジベンゾ[a,m]シクロテトラコセン
  • 5,8,21,24-テトラベンジル-5,8,21,24-テトラアザトリシクロ[26.4.0.012,17]ドトリアコンタン-1(28),12(17),13,15,29,31-ヘキサエン-2,10,18,26-テトライン
  • 5,8,21,24-テトラベンジル-5,8,21,24-テトラアザトリシクロ[26.4.0.012,17]ドトリアコンタ-1(32),12,14,16,28,30-ヘキサエン-2,10,18,26-テトライン
  • 5,8,21,24-tetrabenzyl-5,8,21,24-tetraazatricyclo[26.4.0.012,17]dotriaconta-1(32),12,14,16,28,30-hexaen-2,10,18,26-tetrayne
Other name (2):
  • 8,11,22,25-Tetrabenzyl-7,8,9,10,11,12,21,22,23,24,25,26-dodecahydro-5,6,13,14,19,20,27,28-octadehydro-8,11,22,25-tetraazadibenzo[a,m]cyclotetracosene
  • 5,8,21,24-Tetrabenzyl-5,8,21,24-tetraazatricyclo[26.4.0.012,17]dotriacontane-1(28),12(17),13,15,29,31-hexene-2,10,18,26-tetryne
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