Chem
J-GLOBAL ID:200907013323623451   Nikkaji number:J1.403.989I

4-[4-(1H-Tetrazole-1-yl)phenyl]-3,4-dihydro-2H-1,2,4-triazole-3-one

4-[4-(1H-テトラゾール-1-イル)フェニル]-3,4-ジヒドロ-2H-1,2,4-トリアゾール-3-オン
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: C9H7N7O
Molecular formula furigana: C9-H7-N7-O
Molecular weight: 229.203
InChI: InChI=1S/C9H7N7O/c17-9-12-10-5-15(9)7-1-3-8(4-2-7)16-6-11-13-14-16/h1-6H,(H,12,17)
InChI key: PMBXBZKEHKXBIS-UHFFFAOYSA-N
SMILES: O=c1[nH]ncn1c1ccc(cc1)n1cnnn1
Systematic name  (3):
  • 4-[4-(1H-テトラゾール-1-イル)フェニル]-3,4-ジヒドロ-2H-1,2,4-トリアゾール-3-オン
  • 4-[4-(1H-1,2,3,4-テトラゾール-1-イル)フェニル]-4,5-ジヒドロ-1H-1,2,4-トリアゾール-5-オン
  • 4-[4-(1H-1,2,3,4-tetrazol-1-yl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-5-one
Other name (1):
  • 4-[4-(1H-Tetrazole-1-yl)phenyl]-3,4-dihydro-2H-1,2,4-triazole-3-one
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