Chem
J-GLOBAL ID：200907092391462900   Nikkaji number：J1.523.265J

6,11-Dihydro-dibenzo[b,f][1,4]dioxocin-2-carboxylic acid 3-(5-nitro-1,3-dioxoisoindoline-2-yl)propyl ester

6,11-ジヒドロ-ジベンゾ[b,f][1,4]ジオキソシン-2-カルボン酸3-(5-ニトロ-1,3-ジオキソイソインドリン-2-イル)プロピル
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： C26H20N[N+]O7[O-]
Molecular formula furigana： C26-H20-N2-O8
Molecular weight： 488.452
InChI： InChI=1S/C26H20N2O8/c29-24-20-8-7-19(28(32)33)13-21(20)25(30)27(24)10-3-11-34-26(31)16-6-9-22-23(12-16)36-15-18-5-2-1-4-17(18)14-35-22/h1-2,4-9,12-13H,3,10-11,14-15H2
InChI key： AIAGFBZDHGOZPL-UHFFFAOYSA-N
SMILES： [O-][N+](=O)c1ccc2C(=O)N(CCCOC(=O)c3ccc4OCc5ccccc5COc4c3)C(=O)c2c1
Systematic name  (3)：
  • 6,11-ジヒドロ-ジベンゾ[b,f][1,4]ジオキソシン-2-カルボン酸3-(5-ニトロ-1,3-ジオキソイソインドリン-2-イル)プロピル
  • 3-(5-ニトロ-1,3-ジオキソ-2,3-ジヒドロ-1H-イソインドール-2-イル)プロピル 2,11-ジオキサトリシクロ[10.4.0.04,9]ヘキサデカ-1(16),4,6,8,12,14-ヘキサエン-14-カルボキシラート
  • 3-(5-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propyl 2,11-dioxatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaene-14-carboxylate
Other name (1)：
  • 6,11-Dihydro-dibenzo[b,f][1,4]dioxocin-2-carboxylic acid 3-(5-nitro-1,3-dioxoisoindoline-2-yl)propyl ester
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