Chem
J-GLOBAL ID：200907079035439345   Nikkaji number：J704.201I

1,4,7,8,10,10a-Hexaaza-4H-cyclopenta[a]phenalene-2,3,5,6-tetracarboxylic acid tetramethyl ester

1,4,7,8,10,10a-ヘキサアザ-4H-シクロペンタ[a]フェナレン-2,3,5,6-テトラカルボン酸テトラメチル
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： C18H14N6O8
Molecular formula furigana： C18-H14-N6-O8
Molecular weight： 442.344
InChI： InChI=1S/C18H14N6O8/c1-29-14(25)7-9-6-10(8(15(26)30-2)11(21-9)16(27)31-3)23-18-19-5-20-24(18)13(6)22-12(7)17(28)32-4/h5,21H,1-4H3
InChI key： JZDSWBOOKFTUMB-UHFFFAOYSA-N
SMILES： COC(=O)c1nc2c3c(nc4ncnn24)c(C(=O)OC)c([nH]c3c1C(=O)OC)C(=O)OC
Systematic name  (3)：
  • 1,4,7,8,10,10a-ヘキサアザ-4H-シクロペンタ[a]フェナレン-2,3,5,6-テトラカルボン酸テトラメチル
  • 2,3,6,7-テトラメチル 4,8,10,11,13,15-ヘキサアザテトラシクロ[7.6.1.05,16.010,14]ヘキサデカ-1(15),2,5(16),6,8,11,13-ヘプタエン-2,3,6,7-テトラカルボキシラート
  • 2,3,6,7-tetramethyl 4,8,10,11,13,15-hexaazatetracyclo[7.6.1.05,16.010,14]hexadeca-1(15),2,5(16),6,8,11,13-heptaene-2,3,6,7-tetracarboxylate
Other name (1)：
  • 1,4,7,8,10,10a-Hexaaza-4H-cyclopenta[a]phenalene-2,3,5,6-tetracarboxylic acid tetramethyl ester
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