Chem
J-GLOBAL ID:200907050271636153   Nikkaji number:J288.316C

4,4′-Bis[[1-(3-ethoxyphenylamino)-1,3-dioxobutan-2-yl]azo]-3,3′-dichloro-1,1′-biphenyl

4,4′-ビス[[1-(3-エトキシフェニルアミノ)-1,3-ジオキソブタン-2-イル]アゾ]-3,3′-ジクロロ-1,1′-ビフェニル
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: C36H34Cl2N6O6
Molecular formula furigana: C36-H34-CL2-N6-O6
Molecular weight: 717.600
InChI: InChI=1S/C36H34Cl2N6O6/c1-5-49-27-11-7-9-25(19-27)39-35(47)33(21(3)45)43-41-31-15-13-23(17-29(31)37)24-14-16-32(30(38)18-24)42-44-34(22(4)46)36(48)40-26-10-8-12-28(20-26)50-6-2/h7-20,33-34H,5-6H2,1-4H3,(H,39,47)(H,40,48)
InChI key: KYVZZCCWXNBFEB-UHFFFAOYSA-N
SMILES: CCOc1cccc(NC(=O)C(N=Nc2ccc(cc2Cl)c2ccc(N=NC(C(=O)C)C(=O)Nc3cccc(OCC)c3)c(Cl)c2)C(=O)C)c1
Systematic name  (3):
  • 4,4′-ビス[[1-(3-エトキシフェニルアミノ)-1,3-ジオキソブタン-2-イル]アゾ]-3,3′-ジクロロ-1,1′-ビフェニル
  • 2-{2-[3,3'-ジクロロ-4'-(2-{1-[(3-エトキシフェニル)カルバモイル]-2-オキソプロピル}ジアゼン-1-イル)-[1,1'-ビフェニル]-4-イル]ジアゼン-1-イル}-N-(3-エトキシフェニル)-3-オキソブタンアミド
  • 2-{2-[3,3'-dichloro-4'-(2-{1-[(3-ethoxyphenyl)carbamoyl]-2-oxopropyl}diazen-1-yl)-[1,1'-biphenyl]-4-yl]diazen-1-yl}-N-(3-ethoxyphenyl)-3-oxobutanamide
Other name (1):
  • 4,4′-Bis[[1-(3-ethoxyphenylamino)-1,3-dioxobutan-2-yl]azo]-3,3′-dichloro-1,1′-biphenyl
Regulation number (1):
  • (4)-814
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