Chem
J-GLOBAL ID：200907008865197463   Nikkaji number：J2.576.071I

1-[2-(Benzoyloxy)ethoxymethyl]-3-azido-1H-1,2,4-triazole-5-carboxylic acid methyl ester

1-[2-(ベンゾイルオキシ)エトキシメチル]-3-アジド-1H-1,2,4-トリアゾール-5-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： C14H14N4[N-][N+]O5
Molecular formula furigana： C14-H14-N6-O5
Molecular weight： 346.303
InChI： InChI=1S/C14H14N6O5/c1-23-13(22)11-16-14(17-19-15)18-20(11)9-24-7-8-25-12(21)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3
InChI key： XTRNBBWPPSYRMD-UHFFFAOYSA-N
SMILES： COC(=O)c1nc(N=[N+]=[N-])nn1COCCOC(=O)c1ccccc1
Systematic name  (3)：
  • 1-[2-(ベンゾイルオキシ)エトキシメチル]-3-アジド-1H-1,2,4-トリアゾール-5-カルボン酸メチル
  • メチル 3-アジド-1-{[2-(ベンゾイルオキシ)エトキシ]メチル}-1H-1,2,4-トリアゾール-5-カルボキシラート
  • methyl 3-azido-1-{[2-(benzoyloxy)ethoxy]methyl}-1H-1,2,4-triazole-5-carboxylate
Other name (1)：
  • 1-[2-(Benzoyloxy)ethoxymethyl]-3-azido-1H-1,2,4-triazole-5-carboxylic acid methyl ester
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