Chem
J-GLOBAL ID：200907078427757748   Nikkaji number：J1.523.252H

6,11-Dihydro-8,9-[phenanthrene-9,10-diylbis(oxymethylene)]dibenzo[b,f][1,4]dioxocin-2-carboxylic acid 4-(5-nitro-1,3-dioxoisoindoline-2-yl)butyl ester

6,11-ジヒドロ-8,9-[フェナントレン-9,10-ジイルビス(オキシメチレン)]ジベンゾ[b,f][1,4]ジオキソシン-2-カルボン酸4-(5-ニトロ-1,3-ジオキソイソインドリン-2-イル)ブチル
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： C43H32N[N+]O9[O-]
Molecular formula furigana： C43-H32-N2-O10
Molecular weight： 736.733
InChI： InChI=1S/C43H32N2O10/c46-41-35-13-12-30(45(49)50)20-36(35)42(47)44(41)15-5-6-16-51-43(48)25-11-14-37-38(19-25)53-22-27-18-29-24-55-40-34-10-4-2-8-32(34)31-7-1-3-9-33(31)39(40)54-23-28(29)17-26(27)21-52-37/h1-4,7-14,17-20H,5-6,15-16,21-24H2
InChI key： VDPUHWYLHOLXDV-UHFFFAOYSA-N
SMILES： [O-][N+](=O)c1ccc2C(=O)N(CCCCOC(=O)c3ccc4OCc5cc6COc7c(OCc6cc5COc4c3)c3ccccc3c3ccccc73)C(=O)c2c1
Systematic name  (3)：
  • 6,11-ジヒドロ-8,9-[フェナントレン-9,10-ジイルビス(オキシメチレン)]ジベンゾ[b,f][1,4]ジオキソシン-2-カルボン酸4-(5-ニトロ-1,3-ジオキソイソインドリン-2-イル)ブチル
  • 4-(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)ブチル 3,18,24,31-テトラオキサヘプタシクロ[18.14.0.04,17.05,10.011,16.022,33.025,30]テトラトリアコンタ-1(20),4(17),5,7,9,11,13,15,21,25,27,29,33-トリデカエン-27-カルボキシラート
  • 4-(5-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)butyl 3,18,24,31-tetraoxaheptacyclo[18.14.0.04,17.05,10.011,16.022,33.025,30]tetratriaconta-1(20),4(17),5,7,9,11,13,15,21,25,27,29,33-tridecaene-27-carboxylate
Other name (1)：
  • 6,11-Dihydro-8,9-[phenanthrene-9,10-diylbis(oxymethylene)]dibenzo[b,f][1,4]dioxocin-2-carboxylic acid 4-(5-nitro-1,3-dioxoisoindoline-2-yl)butyl ester
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