Chem
J-GLOBAL ID：200907038161063611   Nikkaji number：J1.664.112J

2,2′-[[(1R,2R)-1,2-Diphenylethylene]bisnitrilomethylidyne]bis(1-mesityl-3-hydroxy-2-butene-1-one)

2,2′-[[(1R,2R)-1,2-ジフェニルエチレン]ビスニトリロメチリジン]ビス(1-メシチル-3-ヒドロキシ-2-ブテン-1-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： C42H44N2O4
Molecular formula furigana： C42-H44-N2-O4
Molecular weight： 640.824
InChI： InChI=1S/C42H44N2O4/c1-25-19-27(3)37(28(4)20-25)41(47)35(31(7)45)23-43-39(33-15-11-9-12-16-33)40(34-17-13-10-14-18-34)44-24-36(32(8)46)42(48)38-29(5)21-26(2)22-30(38)6/h9-24,39-40,45-46H,1-8H3/t39-,40-/m1/s1
InChI key： XIUCUWUUWJGUET-XRSDMRJBSA-N
SMILES： CC(=C(C=N[C@@H]([C@H](N=CC(=C(C)O)C(=O)c1c(C)cc(C)cc1C)c1ccccc1)c1ccccc1)C(=O)c1c(C)cc(C)cc1C)O
Systematic name  (4)：
  • 2,2′-[[(1R,2R)-1,2-ジフェニルエチレン]ビス(2-アザエテン-2,1-ジイル)]ビス[1-(2,4,6-トリメチルフェニル)-3-ヒドロキシ-2-ブテン-1-オン]
  • 2,2′-[[(1R,2R)-1,2-ジフェニルエチレン]ビスニトリロメチリジン]ビス(1-メシチル-3-ヒドロキシ-2-ブテン-1-オン)
  • 3-ヒドロキシ-2-({[(1R,2R)-2-{[2-(1-ヒドロキシエチリデン)-3-オキソ-3-(2,4,6-トリメチルフェニル)プロピリデン]アミノ}-1,2-ジフェニルエチル]イミノ}メチル)-1-(2,4,6-トリメチルフェニル)ブタ-2-エン-1-オン
  • 3-hydroxy-2-({[(1R,2R)-2-{[2-(1-hydroxyethylidene)-3-oxo-3-(2,4,6-trimethylphenyl)propylidene]amino}-1,2-diphenylethyl]imino}methyl)-1-(2,4,6-trimethylphenyl)but-2-en-1-one
Other name (2)：
  • 2,2′-[[(1R,2R)-1,2-Diphenylethylene]bis(2-azaethene-2,1-diyl)]bis[1-(2,4,6-trimethylphenyl)-3-hydroxy-2-butene-1-one]
  • 2,2′-[[(1R,2R)-1,2-Diphenylethylene]bisnitrilomethylidyne]bis(1-mesityl-3-hydroxy-2-butene-1-one)
Thsaurus map：
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