Chem
J-GLOBAL ID:200907076833803391   Nikkaji number:J1.870.663F

1,1′,1′′-(1,5,9-Triazacyclododecane-1,5,9-triyl)tris(1,3,5-cycloheptatriene-7-one)

1,1′,1′′-(1,5,9-トリアザシクロドデカン-1,5,9-トリイル)トリス(1,3,5-シクロヘプタトリエン-7-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: C30H33N3O3
Molecular formula furigana: C30-H33-N3-O3
Molecular weight: 483.612
InChI: InChI=1S/C30H33N3O3/c34-28-16-7-1-4-13-25(28)31-19-10-21-32(26-14-5-2-8-17-29(26)35)23-12-24-33(22-11-20-31)27-15-6-3-9-18-30(27)36/h1-9,13-18H,10-12,19-24H2
InChI key: FPBJQJAJBZVZCP-UHFFFAOYSA-N
SMILES: O=c1cccccc1N1CCCN(CCCN(CCC1)c1cccccc1=O)c1cccccc1=O
Systematic name  (4):
  • 1,1′,1′′-(1,5,9-トリアザシクロドデカン-1,5,9-トリイル)トリス(1,3,5-シクロヘプタトリエン-7-オン)
  • 2,2′,2′′-(1,5,9-トリアザシクロドデカン-1,5,9-トリイル)トリス(2,4,6-シクロヘプタトリエン-1-オン)
  • 2-[5,9-ビス(7-オキソシクロヘプタ-1,3,5-トリエン-1-イル)-1,5,9-トリアザシクロドデカン-1-イル]シクロヘプタ-2,4,6-トリエン-1-オン
  • 2-[5,9-bis(7-oxocyclohepta-1,3,5-trien-1-yl)-1,5,9-triazacyclododecan-1-yl]cyclohepta-2,4,6-trien-1-one
Other name (2):
  • 1,1′,1′′-(1,5,9-Triazacyclododecane-1,5,9-triyl)tris(1,3,5-cycloheptatriene-7-one)
  • 2,2′,2′′-(1,5,9-Triazacyclododecane-1,5,9-triyl)tris(2,4,6-cycloheptatriene-1-one)
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