Chem
J-GLOBAL ID：200907055834417277   Nikkaji number：J1.192.684C

1,3′-[(1,4-Phenylene)bistrimethylene]-1′,3-[(1,4-phenylene)bistrimethylene]bis(1H-indole)

1,3′-[(1,4-フェニレン)ビストリメチレン]-1′,3-[(1,4-フェニレン)ビストリメチレン]ビス(1H-インドール)
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： C40H42N2
Molecular formula furigana： C40-H42-N2
Molecular weight： 550.790
InChI： InChI=1S/C40H42N2/c1-3-17-39-37(15-1)35-13-5-9-31-19-23-34(24-20-31)12-8-28-42-30-36(38-16-2-4-18-40(38)42)14-6-10-32-21-25-33(26-22-32)11-7-27-41(39)29-35/h1-4,15-26,29-30H,5-14,27-28H2
InChI key： NCVZUKUMONEZGM-UHFFFAOYSA-N
SMILES： C1Cc2cn(CCCc3ccc(CCCc4cn(CCCc5ccc(C1)cc5)c1ccccc41)cc3)c1ccccc21
Systematic name  (3)：
  • 1,3′-[(1,4-フェニレン)ビストリメチレン]-1′,3-[(1,4-フェニレン)ビストリメチレン]ビス(1H-インドール)
  • 5,23-ジアザヘプタシクロ[32.2.2.216,19.15,12.123,30.06,11.024,29]ドテトラコンタ-1(36),6,8,10,12(42),16,18,24,26,28,30(39),34,37,40-テトラデカエン
  • 5,23-diazaheptacyclo[32.2.2.216,19.15,12.123,30.06,11.024,29]dotetraconta-1(36),6,8,10,12(42),16,18,24,26,28,30(39),34,37,40-tetradecaene
Other name (1)：
  • 1,3′-[(1,4-Phenylene)bistrimethylene]-1′,3-[(1,4-phenylene)bistrimethylene]bis(1H-indole)
Thsaurus map：
Thesaurus Map

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