Chem
J-GLOBAL ID：200907039004272963   Nikkaji number：J1.523.255B

6,11-Dihydro-8,9-[phenanthrene-9,10-diylbis(oxymethylene)]dibenzo[b,f][1,4]dioxocin-2-carboxylic acid 10-(5-nitro-1,3-dioxoisoindoline-2-yl)decyl 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10-(5-ニトロ-1,3-ジオキソイソインドリン-2-イル)デシル
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： C49H44N[N+]O9[O-]
Molecular formula furigana： C49-H44-N2-O10
Molecular weight： 820.895
InChI： InChI=1S/C49H44N2O10/c52-47-41-19-18-36(51(55)56)26-42(41)48(53)50(47)21-11-5-3-1-2-4-6-12-22-57-49(54)31-17-20-43-44(25-31)59-28-33-24-35-30-61-46-40-16-10-8-14-38(40)37-13-7-9-15-39(37)45(46)60-29-34(35)23-32(33)27-58-43/h7-10,13-20,23-26H,1-6,11-12,21-22,27-30H2
InChI key： UYUFGFMSICPOTA-UHFFFAOYSA-N
SMILES： [O-][N+](=O)c1ccc2C(=O)N(CCCCCCCCCCOC(=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10-(5-ニトロ-1,3-ジオキソイソインドリン-2-イル)デシル
  • 10-(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)デシル 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
  • 10-(5-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)decyl 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 10-(5-nitro-1,3-dioxoisoindoline-2-yl)decyl ester
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