Chem
J-GLOBAL ID：200907034900506866   Nikkaji number：J701.937H

1,4,7-Triaza-1H-phenalene-2,3,5,6,8,9-hexacarboxylic acid hexamethyl ester

1,4,7-トリアザ-1H-フェナレン-2,3,5,6,8,9-ヘキサカルボン酸ヘキサメチル
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： C22H19N3O12
Molecular formula furigana： C22-H19-N3-O12
Molecular weight： 517.403
InChI： InChI=1S/C22H19N3O12/c1-32-17(26)8-11-7-12(24-14(8)20(29)35-4)9(18(27)33-2)16(22(31)37-6)25-13(7)10(19(28)34-3)15(23-11)21(30)36-5/h23H,1-6H3
InChI key： OKCFVNJATQPPBU-UHFFFAOYSA-N
SMILES： COC(=O)c1nc2c(C(=O)OC)c([nH]c3c(C(=O)OC)c(nc(c1C(=O)OC)c23)C(=O)OC)C(=O)OC
Systematic name  (3)：
  • 1,4,7-トリアザ-1H-フェナレン-2,3,5,6,8,9-ヘキサカルボン酸ヘキサメチル
  • 3,4,7,8,11,12-ヘキサメチル 2,6,10-トリアザトリシクロ[7.3.1.05,13]トリデカ-1,3,5(13),6,8,11-ヘキサエン-3,4,7,8,11,12-ヘキサカルボキシラート
  • 3,4,7,8,11,12-hexamethyl 2,6,10-triazatricyclo[7.3.1.05,13]trideca-1,3,5(13),6,8,11-hexaene-3,4,7,8,11,12-hexacarboxylate
Other name (1)：
  • 1,4,7-Triaza-1H-phenalene-2,3,5,6,8,9-hexacarboxylic acid hexamethyl ester
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM