Chem
J-GLOBAL ID：201707020455698808   Nikkaji number：J3.607.577E

4,4′-[(2,8-Dimethyl-5,6,11,12-tetrahydro-5,11-methanodibenzo[b,f][1,5]diazocine-3,9-diyl)bisazo]bis(2,6-dimethylphenol)

4,4′-[(2,8-ジメチル-5,6,11,12-テトラヒドロ-5,11-メタノジベンゾ[b,f][1,5]ジアゾシン-3,9-ジイル)ビスアゾ]ビス(2,6-ジメチルフェノール)
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： C33H34N6O2
Molecular formula furigana： C33-H34-N6-O2
Molecular weight： 546.675
InChI： InChI=1S/C33H34N6O2/c1-18-7-24-15-38-17-39(30(24)13-28(18)36-34-26-9-20(3)32(40)21(4)10-26)16-25-8-19(2)29(14-31(25)38)37-35-27-11-22(5)33(41)23(6)12-27/h7-14,40-41H,15-17H2,1-6H3
InChI key： QFDLCGOHGGWPJO-UHFFFAOYSA-N
SMILES： Cc1cc(cc(C)c1O)N=Nc1cc2N3CN(Cc2cc1C)c1cc(N=Nc2cc(C)c(O)c(C)c2)c(C)cc1C3
Systematic name  (3)：
  • 4,4′-[(2,8-ジメチル-5,6,11,12-テトラヒドロ-5,11-メタノジベンゾ[b,f][1,5]ジアゾシン-3,9-ジイル)ビスアゾ]ビス(2,6-ジメチルフェノール)
  • 4-(2-{12-[2-(4-ヒドロキシ-3,5-ジメチルフェニル)ジアゼン-1-イル]-5,13-ジメチル-1,9-ジアザテトラシクロ[7.7.1.02,7.010,15]ヘプタデカ-2(7),3,5,10,12,14-ヘキサエン-4-イル}ジアゼン-1-イル)-2,6-ジメチルフェノール
  • 4-(2-{12-[2-(4-hydroxy-3,5-dimethylphenyl)diazen-1-yl]-5,13-dimethyl-1,9-diazatetracyclo[7.7.1.02,7.010,15]heptadeca-2(7),3,5,10,12,14-hexaen-4-yl}diazen-1-yl)-2,6-dimethylphenol
Other name (1)：
  • 4,4′-[(2,8-Dimethyl-5,6,11,12-tetrahydro-5,11-methanodibenzo[b,f][1,5]diazocine-3,9-diyl)bisazo]bis(2,6-dimethylphenol)
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