Chem
J-GLOBAL ID：201207036414457010   Nikkaji number：J3.003.694H

4-Isopropyl-2,6-[(cyclohexane-1α,2β-diyl)bis[nitrilomethylidyne(2-hydroxy-5-isopropyl-m-phenylene)methylidynenitrilo(cyclohexane-1α,2β-diyl)nitrilomethylidyne]]phenol

4-イソプロピル-2,6-[(シクロヘキサン-1α,2β-ジイル)ビス[ニトリロメチリジン(2-ヒドロキシ-5-イソプロピル-m-フェニレン)メチリジンニトリロ(シクロヘキサン-1α,2β-ジイル)ニトリロメチリジン]]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： C51H66N6O3
Molecular formula furigana： C51-H66-N6-O3
Molecular weight： 811.128
InChI： InChI=1S/C51H66N6O3/c1-31(2)34-19-37-25-52-43-13-7-9-15-45(43)54-27-39-21-35(32(3)4)23-41(50(39)59)29-56-47-17-11-12-18-48(47)57-30-42-24-36(33(5)6)22-40(51(42)60)28-55-46-16-10-8-14-44(46)53-26-38(20-34)49(37)58/h19-33,43-48,58-60H,7-18H2,1-6H3/t43-,44-,45-,46-,47-,48-/m0/s1
InChI key： GJIJJCBQKIASFR-RYICAFHUSA-N
SMILES： CC(C)c1cc2C=N[C@H]3CCCC[C@@H]3N=Cc3cc(cc(C=N[C@H]4CCCC[C@@H]4N=Cc4cc(cc(C=N[C@H]5CCCC[C@@H]5N=Cc(c1)c2O)c4O)C(C)C)c3O)C(C)C
Systematic name  (4)：
  • 2,6-[[(1S)-シクロヘキサン-1α,2β-ジイル]ビス[ニトリロメチリジン(2-ヒドロキシ-5-イソプロピル-1,3-フェニレン)メチリジンニトリロ[(1S)-シクロヘキサン-1α,2β-ジイル]ニトリロメチリジン]]-4-イソプロピルフェノール
  • 4-イソプロピル-2,6-[(シクロヘキサン-1α,2β-ジイル)ビス[ニトリロメチリジン(2-ヒドロキシ-5-イソプロピル-m-フェニレン)メチリジンニトリロ(シクロヘキサン-1α,2β-ジイル)ニトリロメチリジン]]フェノール
  • (4S,9S,19S,24S,34S,39S)-14,29,44-トリス(プロパン-2-イル)-3,10,18,25,33,40-ヘキサアザヘプタシクロ[40.3.1.112,16.127,31.04,9.019,24.034,39]オクタテトラコンタ-1(46),2,10,12,14,16(48),17,25,27,29,31(47),32,40,42,44-ペンタデカエン-46,47,48-トリオール
  • (4S,9S,19S,24S,34S,39S)-14,29,44-tris(propan-2-yl)-3,10,18,25,33,40-hexaazaheptacyclo[40.3.1.112,16.127,31.04,9.019,24.034,39]octatetraconta-1(46),2,10,12,14,16(48),17,25,27,29,31(47),32,40,42,44-pentadecaene-46,47,48-triol
Other name (2)：
  • 2,6-[[(1S)-Cyclohexane-1α,2β-diyl]bis[nitrilomethylidyne(2-hydroxy-5-isopropyl-1,3-phenylene)methylidynenitrilo[(1S)-cyclohexane-1α,2β-diyl]nitrilomethylidyne]]-4-isopropylphenol
  • 4-Isopropyl-2,6-[(cyclohexane-1α,2β-diyl)bis[nitrilomethylidyne(2-hydroxy-5-isopropyl-m-phenylene)methylidynenitrilo(cyclohexane-1α,2β-diyl)nitrilomethylidyne]]phenol
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