Chem
J-GLOBAL ID：200907086300270494   Nikkaji number：J1.860.058G

[1,4-Phenylenebisnitrilotetrakis[4,1-phenylene[(4,4,5,5-tetramethyl-1H-imidazole 3-oxide)-2,1-diyl]oxy]]radical

[1,4-フェニレンビスニトリロテトラキス[4,1-フェニレン[(4,4,5,5-テトラメチル-1H-イミダゾール3-オキシド)-2,1-ジイル]オキシ]]ラジカル
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： C58H68N6[N+]4O4[O-]4
Molecular formula furigana： C58-H68-N10-O8
Molecular weight： 1033.243
InChI： InChI=1S/C58H68N10O8/c1-51(2)52(3,4)62(70)47(61(51)69)37-17-25-41(26-18-37)59(42-27-19-38(20-28-42)48-63(71)53(5,6)54(7,8)64(48)72)45-33-35-46(36-34-45)60(43-29-21-39(22-30-43)49-65(73)55(9,10)56(11,12)66(49)74)44-31-23-40(24-32-44)50-67(75)57(13,14)58(15,16)68(50)76/h17-36H,1-16H3
InChI key： KGSFXBFSMWHHGS-UHFFFAOYSA-N
SMILES： CC1(C)N([O])C(=[N+]([O-])C1(C)C)c1ccc(cc1)N(c1ccc(cc1)N(c1ccc(cc1)C1=[N+]([O-])C(C)(C)C(C)(C)N1[O])c1ccc(cc1)C1=[N+]([O-])C(C)(C)C(C)(C)N1[O])c1ccc(cc1)C1=[N+]([O-])C(C)(C)C(C)(C)N1[O]
Systematic name  (2)：
  • [[2,2′,2′′,2′′′-[p-フェニレンビスニトリロテトラキス(p-フェニレン)]テトラキス[4,5-ジヒドロ-3-オキシラト-4,4,5,5-テトラメチル-1H-イミダゾール-3-イウム]]-1,1′,1′′,1′′′-テトライルテトラオキシ]ラジカル
  • [1,4-フェニレンビスニトリロテトラキス[4,1-フェニレン[(4,4,5,5-テトラメチル-1H-イミダゾール3-オキシド)-2,1-ジイル]オキシ]]ラジカル
Other name (2)：
  • [[2,2′,2′′,2′′′-[p-Phenylenebisnitrilotetrakis(p-phenylene)]tetrakis[4,5-dihydro-3-oxylato-4,4,5,5-tetramethyl-1H-imidazole-3-ium]]-1,1′,1′′,1′′′-tetryltetraoxy]radical
  • [1,4-Phenylenebisnitrilotetrakis[4,1-phenylene[(4,4,5,5-tetramethyl-1H-imidazole 3-oxide)-2,1-diyl]oxy]]radical
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