Chem
J-GLOBAL ID：200907014465752751   Nikkaji number：J999.866G

2,2′-[[2,2′-Dimethyl-5,5′-bis(propoxy)-1,1′-biphenyl-4,4′-diyl]bis(azo)]bis[3-hydroxy-N-(4-methoxyphenyl)-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-(4-メトキシフェニル)-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： C42H48N6O8
Molecular formula furigana： C42-H48-N6-O8
Molecular weight： 764.880
InChI： InChI=1S/C42H48N6O8/c1-9-19-55-37-23-33(25(3)21-35(37)45-47-39(27(5)49)41(51)43-29-11-15-31(53-7)16-12-29)34-24-38(56-20-10-2)36(22-26(34)4)46-48-40(28(6)50)42(52)44-30-13-17-32(54-8)18-14-30/h11-18,21-24,49-50H,9-10,19-20H2,1-8H3,(H,43,51)(H,44,52)
InChI key： GHYMERPCERWCBR-UHFFFAOYSA-N
SMILES： CCCOc1cc(c(C)cc1N=NC(=C(C)O)C(=O)Nc1ccc(OC)cc1)c1cc(OCCC)c(cc1C)N=NC(=C(C)O)C(=O)Nc1ccc(OC)cc1
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-(4-メトキシフェニル)-2-ブテンアミド]
  • 3-ヒドロキシ-2-{2-[4'-(2-{2-ヒドロキシ-1-[(4-メトキシフェニル)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-(4-メトキシフェニル)ブタ-2-エンアミド
  • 3-hydroxy-2-{2-[4'-(2-{2-hydroxy-1-[(4-methoxyphenyl)carbamoyl]prop-1-en-1-yl}diazen-1-yl)-2,2'-dimethyl-5,5'-dipropoxy-[1,1'-biphenyl]-4-yl]diazen-1-yl}-N-(4-methoxyphenyl)but-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-(4-methoxyphenyl)-2-butenamide]
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