Chem
J-GLOBAL ID:200907002717935295   Nikkaji number:J2.012.544F

N,N′-[2,6-Pyridinediylbis(carbonylimino)bis(3,5-dimethyl-4,1-phenylene)bis(cyclohexane-1,1-diyl)bis(2,6-dimethyl-4,1-phenylene)]-4-nitro-2,6-pyridinedicarboxamide

N,N′-[2,6-ピリジンジイルビス(カルボニルイミノ)ビス(3,5-ジメチル-4,1-フェニレン)ビス(シクロヘキサン-1,1-ジイル)ビス(2,6-ジメチル-4,1-フェニレン)]-4-ニトロ-2,6-ピリジンジカルボアミド
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: C58H61N6[N+]O5[O-]
Molecular formula furigana: C58-H61-N7-O6
Molecular weight: 952.169
InChI: InChI=1S/C58H61N7O6/c1-32-22-40-23-33(2)49(32)61-53(66)45-16-15-17-46(59-45)54(67)62-50-34(3)24-41(25-35(50)4)58(20-13-10-14-21-58)43-28-38(7)52(39(8)29-43)64-56(69)48-31-44(65(70)71)30-47(60-48)55(68)63-51-36(5)26-42(27-37(51)6)57(40)18-11-9-12-19-57/h15-17,22-31H,9-14,18-21H2,1-8H3,(H,61,66)(H,62,67)(H,63,68)(H,64,69)
InChI key: HQQUHIULBSHXDD-UHFFFAOYSA-N
SMILES: Cc1cc2cc(C)c1NC(=O)c1cccc(n1)C(=O)Nc1c(C)cc(cc1C)C1(CCCCC1)c1cc(C)c(NC(=O)c3cc(cc(n3)C(=O)Nc3c(C)cc(cc3C)C32CCCCC3)[N+](=O)[O-])c(C)c1
Systematic name  (3):
  • N,N′-[2,6-ピリジンジイルビス(カルボニルイミノ)ビス(3,5-ジメチル-4,1-フェニレン)ビス(シクロヘキサン-1,1-ジイル)ビス(2,6-ジメチル-4,1-フェニレン)]-4-ニトロ-2,6-ピリジンジカルボアミド
  • 5',17',23',35',38',40',43',45'-オクタメチル-11'-ニトロジスピロ[シクロヘキサン-1,2'-[7,15,25,33,39,44]ヘキサアザヘプタシクロ[32.2.2.23,6.216,19.221,24.19,13.127,31]ヘキサテトラコンタン-20',1''-シクロヘキサン]-1'(36'),3',5',9',11',13'(44'),16',18',21',23',27',29',31'(39'),34',37',40',42',45'-オクタデカエン-8',14',26',32'-テトラオン
  • 5',17',23',35',38',40',43',45'-octamethyl-11'-nitrodispiro[cyclohexane-1,2'-[7,15,25,33,39,44]hexaazaheptacyclo[32.2.2.23,6.216,19.221,24.19,13.127,31]hexatetracontane-20',1''-cyclohexan]-1'(36'),3',5',9',11',13'(44'),16',18',21',23',27',29',31'(39'),34',37',40',42',45'-octadecaene-8',14',26',32'-tetrone
Other name (1):
  • N,N′-[2,6-Pyridinediylbis(carbonylimino)bis(3,5-dimethyl-4,1-phenylene)bis(cyclohexane-1,1-diyl)bis(2,6-dimethyl-4,1-phenylene)]-4-nitro-2,6-pyridinedicarboxamide
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