Chem
J-GLOBAL ID：200907075350981292   Nikkaji number：J1.371.144E

1,17:9,25-Bis[(pyridine-2,6-diyl)bismethylene]-7,3:15,11:23,19:31,27-tetraepinitrilo-1,9,17,25-tetraazacyclodotriacontane-4,6,12,14,20,22,28,30-octene

1,17:9,25-ビス[(ピリジン-2,6-ジイル)ビスメチレン]-7,3:15,11:23,19:31,27-テトラエピニトリロ-1,9,17,25-テトラアザシクロドトリアコンタン-4,6,12,14,20,22,28,30-オクタエン
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： C42H42N10
Molecular formula furigana： C42-H42-N10
Molecular weight： 686.868
InChI： InChI=1S/C42H42N10/c1-7-31-19-49-21-33-9-2-13-37(44-33)25-51-26-38-14-4-11-35(46-38)23-50(20-32(8-1)43-31)24-36-12-5-16-40(47-36)28-52(27-39-15-3-10-34(22-49)45-39)30-42-18-6-17-41(29-51)48-42/h1-18H,19-30H2
InChI key： UFTTWFNAHZKVQJ-UHFFFAOYSA-N
SMILES： C1N2Cc3cccc(CN4Cc5cccc(CN(Cc6cccc1n6)Cc1cccc(CN(Cc6cccc(C2)n6)Cc2cccc(C4)n2)n1)n5)n3
Systematic name  (4)：
  • 3,19:11,27-ビス(2,6-ピリジンジイルビスメチレン)-3,11,19,27,33,34,35,36-オクタアザペンタシクロ[27.3.1.15,9.113,17.121,25]ヘキサトリアコンタ-1(33),5(36),6,8,13(35),14,16,21(34),22,24,29,31-ドデカエン
  • 1,17:9,25-ビス[(ピリジン-2,6-ジイル)ビスメチレン]-7,3:15,11:23,19:31,27-テトラエピニトリロ-1,9,17,25-テトラアザシクロドトリアコンタン-4,6,12,14,20,22,28,30-オクタエン
  • 1,9,17,25,40,41,49,50,51,52-デカアザノナシクロ[15.15.7.79,25.13,7.111,15.119,23.127,31.134,38.143,47]ドペンタコンタ-3,5,7(51),11,13,15(50),19,21,23(49),27,29,31(41),34,36,38(40),43,45,47(52)-オクタデカエン
  • 1,9,17,25,40,41,49,50,51,52-decaazanonacyclo[15.15.7.79,25.13,7.111,15.119,23.127,31.134,38.143,47]dopentaconta-3,5,7(51),11,13,15(50),19,21,23(49),27,29,31(41),34,36,38(40),43,45,47(52)-octadecaene
Other name (2)：
  • 3,19:11,27-Bis(2,6-pyridinediylbismethylene)-3,11,19,27,33,34,35,36-octaazapentacyclo[27.3.1.15,9.113,17.121,25]hexatriaconta-1(33),5(36),6,8,13(35),14,16,21(34),22,24,29,31-dodecene
  • 1,17:9,25-Bis[(pyridine-2,6-diyl)bismethylene]-7,3:15,11:23,19:31,27-tetraepinitrilo-1,9,17,25-tetraazacyclodotriacontane-4,6,12,14,20,22,28,30-octene
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