Chem
J-GLOBAL ID：200907019330827893   Nikkaji number：J999.864K

2,2′-[[2,2′-Dimethyl-5,5′-bis(propoxy)-1,1′-biphenyl-4,4′-diyl]bis(azo)]bis(3-hydroxy-N-phenyl-2-butenamide)

2,2′-[[2,2′-ジメチル-5,5′-ビス(プロポキシ)-1,1′-ビフェニル-4,4′-ジイル]ビス(アゾ)]ビス(3-ヒドロキシ-N-フェニル-2-ブテンアミド)
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： C40H44N6O6
Molecular formula furigana： C40-H44-N6-O6
Molecular weight： 704.828
InChI： InChI=1S/C40H44N6O6/c1-7-19-51-35-23-31(25(3)21-33(35)43-45-37(27(5)47)39(49)41-29-15-11-9-12-16-29)32-24-36(52-20-8-2)34(22-26(32)4)44-46-38(28(6)48)40(50)42-30-17-13-10-14-18-30/h9-18,21-24,47-48H,7-8,19-20H2,1-6H3,(H,41,49)(H,42,50)
InChI key： BRINCROVBFELTI-UHFFFAOYSA-N
SMILES： CCCOc1cc(c(C)cc1N=NC(=C(C)O)C(=O)Nc1ccccc1)c1cc(OCCC)c(cc1C)N=NC(=C(C)O)C(=O)Nc1ccccc1
Systematic name  (3)：
  • 2,2′-[[2,2′-ジメチル-5,5′-ビス(プロポキシ)-1,1′-ビフェニル-4,4′-ジイル]ビス(アゾ)]ビス(3-ヒドロキシ-N-フェニル-2-ブテンアミド)
  • 3-ヒドロキシ-2-[2-(4'-{2-[2-ヒドロキシ-1-(フェニルカルバモイル)プロパ-1-エン-1-イル]ジアゼン-1-イル}-2,2'-ジメチル-5,5'-ジプロポキシ-[1,1'-ビフェニル]-4-イル)ジアゼン-1-イル]-N-フェニルブタ-2-エンアミド
  • 3-hydroxy-2-[2-(4'-{2-[2-hydroxy-1-(phenylcarbamoyl)prop-1-en-1-yl]diazen-1-yl}-2,2'-dimethyl-5,5'-dipropoxy-[1,1'-biphenyl]-4-yl)diazen-1-yl]-N-phenylbut-2-enamide
Other name (1)：
  • 2,2′-[[2,2′-Dimethyl-5,5′-bis(propoxy)-1,1′-biphenyl-4,4′-diyl]bis(azo)]bis(3-hydroxy-N-phenyl-2-butenamide)
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