Chem
J-GLOBAL ID：200907078230237548   Nikkaji number：J1.964.603C

3,3′-[[(1R,2R)-1,2-Cyclohexanediyl]bis(nitrilomethylidyne)]bis(4-mesityl-4-oxo-2-butene-2-olanion)

3,3′-[[(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-メシチル-4-オキソ-2-ブテン-2-オールアニオン)
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： C34H40N2O2[O-]2
Molecular formula furigana： C34-H40-N2-O4
Molecular weight： 540.705
InChI： InChI=1S/C34H42N2O4/c1-19-13-21(3)31(22(4)14-19)33(39)27(25(7)37)17-35-29-11-9-10-12-30(29)36-18-28(26(8)38)34(40)32-23(5)15-20(2)16-24(32)6/h13-18,29-30,37-38H,9-12H2,1-8H3/p-2/t29-,30-/m1/s1
InChI key： XVHWCYULLAADPA-LOYHVIPDSA-L
SMILES： CC(=C(C=N[C@@H]1CCCC[C@H]1N=CC(=C(C)[O-])C(=O)c1c(C)cc(C)cc1C)C(=O)c1c(C)cc(C)cc1C)[O-]
Systematic name  (3)：
  • 3,3′-[[(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-メシチル-4-オキソ-2-ブテン-2-オールアニオン)
  • 3-({[(1R,2R)-2-{[3-オキシド-2-(2,4,6-トリメチルベンゾイル)ブタ-2-エン-1-イリデン]アミノ}シクロヘキシル]イミノ}メチル)-4-オキソ-4-(2,4,6-トリメチルフェニル)ブタ-2-エン-2-オラート
  • 3-({[(1R,2R)-2-{[3-oxido-2-(2,4,6-trimethylbenzoyl)but-2-en-1-ylidene]amino}cyclohexyl]imino}methyl)-4-oxo-4-(2,4,6-trimethylphenyl)but-2-en-2-olate
Other name (1)：
  • 3,3′-[[(1R,2R)-1,2-Cyclohexanediyl]bis(nitrilomethylidyne)]bis(4-mesityl-4-oxo-2-butene-2-olanion)
Thsaurus map：
Thesaurus Map

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