Chem
J-GLOBAL ID：201707006853529150   Nikkaji number：J3.604.247H

5-[[3-(4-Nitrophenylazo)-6-hydroxybenzylidene]amino]isophthalic acid diethyl ester

5-[[3-(4-ニトロフェニルアゾ)-6-ヒドロキシベンジリデン]アミノ]イソフタル酸ジエチル
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： C25H22N3[N+]O6[O-]
Molecular formula furigana： C25-H22-N4-O7
Molecular weight： 490.472
InChI： InChI=1S/C25H22N4O7/c1-3-35-24(31)16-11-17(25(32)36-4-2)13-21(12-16)26-15-18-14-20(7-10-23(18)30)28-27-19-5-8-22(9-6-19)29(33)34/h5-15,30H,3-4H2,1-2H3
InChI key： BXEICNRELDJFIN-UHFFFAOYSA-N
SMILES： CCOC(=O)c1cc(cc(c1)C(=O)OCC)N=Cc1cc(ccc1O)N=Nc1ccc(cc1)[N+](=O)[O-]
Systematic name  (3)：
  • 5-[[3-(4-ニトロフェニルアゾ)-6-ヒドロキシベンジリデン]アミノ]イソフタル酸ジエチル
  • 1,3-ジエチル 5-[({2-ヒドロキシ-5-[2-(4-ニトロフェニル)ジアゼン-1-イル]フェニル}メチリデン)アミノ]ベンゼン-1,3-ジカルボキシラート
  • 1,3-diethyl 5-[({2-hydroxy-5-[2-(4-nitrophenyl)diazen-1-yl]phenyl}methylidene)amino]benzene-1,3-dicarboxylate
Other name (1)：
  • 5-[[3-(4-Nitrophenylazo)-6-hydroxybenzylidene]amino]isophthalic acid diethyl ester
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