Chem
J-GLOBAL ID：200907064452895755   Nikkaji number：J701.940H

1,4,7,8,10-Pentaaza-8,9,10,11-tetrahydro-8,10-dimethyl-9,11-dioxo-4H-benz[de]anthracene-2,3,5,6-tetracarboxylic acid tetraethyl ester

1,4,7,8,10-ペンタアザ-8,9,10,11-テトラヒドロ-8,10-ジメチル-9,11-ジオキソ-4H-ベンゾ[de]アントラセン-2,3,5,6-テトラカルボン酸テトラエチル
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： C26H27N5O10
Molecular formula furigana： C26-H27-N5-O10
Molecular weight： 569.527
InChI： InChI=1S/C26H27N5O10/c1-7-38-22(33)12-15-11-16(13(23(34)39-8-2)19(27-15)25(36)41-10-4)29-20-14(21(32)31(6)26(37)30(20)5)17(11)28-18(12)24(35)40-9-3/h27H,7-10H2,1-6H3
InChI key： FCIDHHQABOQTOP-UHFFFAOYSA-N
SMILES： CCOC(=O)c1nc2c3c(nc4n(C)c(=O)n(C)c(=O)c24)c(C(=O)OCC)c([nH]c3c1C(=O)OCC)C(=O)OCC
Systematic name  (3)：
  • 1,4,7,8,10-ペンタアザ-8,9,10,11-テトラヒドロ-8,10-ジメチル-9,11-ジオキソ-4H-ベンゾ[de]アントラセン-2,3,5,6-テトラカルボン酸テトラエチル
  • 10,11,14,15-テトラエチル 4,6-ジメチル-3,5-ジオキソ-4,6,8,12,16-ペンタアザテトラシクロ[7.7.1.02,7.013,17]ヘプタデカ-1,7,9(17),10,13,15-ヘキサエン-10,11,14,15-テトラカルボキシラート
  • 10,11,14,15-tetraethyl 4,6-dimethyl-3,5-dioxo-4,6,8,12,16-pentaazatetracyclo[7.7.1.02,7.013,17]heptadeca-1,7,9(17),10,13,15-hexaene-10,11,14,15-tetracarboxylate
Other name (1)：
  • 1,4,7,8,10-Pentaaza-8,9,10,11-tetrahydro-8,10-dimethyl-9,11-dioxo-4H-benz[de]anthracene-2,3,5,6-tetracarboxylic acid tetraethyl ester
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