Chem
J-GLOBAL ID：200907004365055861   Nikkaji number：J2.189.458C

1,3-Dihydro-1,3-dioxo-2-[4-(4-amino-3,5-dimethylbenzyl)-2,6-dimethylphenyl]-2H-isoindole-5-carboxylic acid 2-(4-nitrophenylazo)-5-hydroxyphenyl ester

1,3-ジヒドロ-1,3-ジオキソ-2-[4-(4-アミノ-3,5-ジメチルベンジル)-2,6-ジメチルフェニル]-2H-イソインドール-5-カルボン酸2-(4-ニトロフェニルアゾ)-5-ヒドロキシフェニル
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： C38H31N4[N+]O6[O-]
Molecular formula furigana： C38-H31-N5-O7
Molecular weight： 669.694
InChI： InChI=1S/C38H31N5O7/c1-20-13-24(14-21(2)34(20)39)17-25-15-22(3)35(23(4)16-25)42-36(45)30-11-5-26(18-31(30)37(42)46)38(47)50-33-19-29(44)10-12-32(33)41-40-27-6-8-28(9-7-27)43(48)49/h5-16,18-19,44H,17,39H2,1-4H3
InChI key： MJYVIELGGUYFDA-UHFFFAOYSA-N
SMILES： Cc1cc(Cc2cc(C)c(N3C(=O)c4ccc(cc4C3=O)C(=O)Oc3cc(O)ccc3N=Nc3ccc(cc3)[N+](=O)[O-])c(C)c2)cc(C)c1N
Systematic name  (3)：
  • 1,3-ジヒドロ-1,3-ジオキソ-2-[4-(4-アミノ-3,5-ジメチルベンジル)-2,6-ジメチルフェニル]-2H-イソインドール-5-カルボン酸2-(4-ニトロフェニルアゾ)-5-ヒドロキシフェニル
  • 5-ヒドロキシ-2-[2-(4-ニトロフェニル)ジアゼン-1-イル]フェニル 2-{4-[(4-アミノ-3,5-ジメチルフェニル)メチル]-2,6-ジメチルフェニル}-1,3-ジオキソ-2,3-ジヒドロ-1H-イソインドール-5-カルボキシラート
  • 5-hydroxy-2-[2-(4-nitrophenyl)diazen-1-yl]phenyl 2-{4-[(4-amino-3,5-dimethylphenyl)methyl]-2,6-dimethylphenyl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Other name (1)：
  • 1,3-Dihydro-1,3-dioxo-2-[4-(4-amino-3,5-dimethylbenzyl)-2,6-dimethylphenyl]-2H-isoindole-5-carboxylic acid 2-(4-nitrophenylazo)-5-hydroxyphenyl ester
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