Chem
J-GLOBAL ID：200907069987026782   Nikkaji number：J1.112.821A

2,2′-[(Cyclohexane-1β,2α-diyl)bisnitrilomethylidyne]bis(4-nitro-6-tert-butylphenol)

2,2′-[(シクロヘキサン-1β,2α-ジイル)ビスニトリロメチリジン]ビス(4-ニトロ-6-tert-ブチルフェノール)
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： C28H36N2[N+]2O4[O-]2
Molecular formula furigana： C28-H36-N4-O6
Molecular weight： 524.618
InChI： InChI=1S/C28H36N4O6/c1-27(2,3)21-13-19(31(35)36)11-17(25(21)33)15-29-23-9-7-8-10-24(23)30-16-18-12-20(32(37)38)14-22(26(18)34)28(4,5)6/h11-16,23-24,33-34H,7-10H2,1-6H3/t23-,24-/m1/s1
InChI key： QGPWJWZLXCSOBQ-DNQXCXABSA-N
SMILES： CC(C)(C)c1cc(cc(C=N[C@@H]2CCCC[C@H]2N=Cc2cc(cc(c2O)C(C)(C)C)[N+](=O)[O-])c1O)[N+](=O)[O-]
Systematic name  (5)：
  • 2,2′-[(シクロヘキサン-1β,2α-ジイル)ビスニトリロメチリジン]ビス(4-ニトロ-6-tert-ブチルフェノール)
  • 6,6′-[[(1R,2R)-1,2-シクロヘキサンジイル]ビス(ニトリロメチリジン)]ビス(2-tert-ブチル-4-ニトロフェノール)
  • 2,2′-[[(1R,2R)-1,2-シクロヘキサンジイル]ビス(ニトリロメチリジン)]ビス(4-ニトロ-6-tert-ブチルフェノール)
  • 2-tert-ブチル-6-({[(1R,2R)-2-{[(3-tert-ブチル-2-ヒドロキシ-5-ニトロフェニル)メチリデン]アミノ}シクロヘキシル]イミノ}メチル)-4-ニトロフェノール
  • 2-tert-butyl-6-({[(1R,2R)-2-{[(3-tert-butyl-2-hydroxy-5-nitrophenyl)methylidene]amino}cyclohexyl]imino}methyl)-4-nitrophenol
Other name (3)：
  • 2,2′-[(Cyclohexane-1β,2α-diyl)bisnitrilomethylidyne]bis(4-nitro-6-tert-butylphenol)
  • 6,6′-[[(1R,2R)-1,2-Cyclohexanediyl]bis(nitrilomethylidyne)]bis(2-tert-butyl-4-nitrophenol)
  • 2,2′-[[(1R,2R)-1,2-Cyclohexanediyl]bis(nitrilomethylidyne)]bis(4-nitro-6-tert-butylphenol)
Thsaurus map：
Thesaurus Map

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