Chem
J-GLOBAL ID：200907081534133944   Nikkaji number：J757.753B

3,3a,5a-Triaza-as-indacene-1-carboxylic acid methyl ester

3,3a,5a-トリアザ-as-インダセン-1-カルボン酸メチル
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： C11H9N3O2
Molecular formula furigana： C11-H9-N3-O2
Molecular weight： 215.212
InChI： InChI=1S/C11H9N3O2/c1-16-11(15)8-7-12-14-6-5-13-4-2-3-9(13)10(8)14/h2-7H,1H3
InChI key： HATGWWNIVYIKQC-UHFFFAOYSA-N
SMILES： COC(=O)c1cnn2ccn3cccc3c12
Systematic name  (3)：
  • 3,3a,5a-トリアザ-as-インダセン-1-カルボン酸メチル
  • メチル 5,6,9-トリアザトリシクロ[7.3.0.02,6]ドデカ-1(12),2,4,7,10-ペンタエン-3-カルボキシラート
  • methyl 5,6,9-triazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,7,10-pentaene-3-carboxylate
Other name (1)：
  • 3,3a,5a-Triaza-as-indacene-1-carboxylic acid methyl ester
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