Chem
J-GLOBAL ID:200907062955605280   Nikkaji number:J699.820H

10-Oxo-9,10-dihydro-3-oxa-4-thia-9-azabenz[f]azulene-2-carboxylic acid methyl ester

10-オキソ-9,10-ジヒドロ-3-オキサ-4-チア-9-アザベンゾ[f]アズレン-2-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: C13H9NO4S
Molecular formula furigana: C13-H9-N-O4-S
Molecular weight: 275.280
InChI: InChI=1S/C13H9NO4S/c1-17-12(16)9-6-7-11(15)14-8-4-2-3-5-10(8)19-13(7)18-9/h2-6H,1H3,(H,14,15)
InChI key: VHQVBVAKNHBELC-UHFFFAOYSA-N
SMILES: COC(=O)c1cc2c(Sc3ccccc3NC2=O)o1
Systematic name  (4):
  • 10-オキソ-9,10-ジヒドロ-3-オキサ-4-チア-9-アザベンゾ[f]アズレン-2-カルボン酸メチル
  • 9,10-ジヒドロ-10-オキソ-3-オキサ-4-チア-9-アザベンゾ[f]アズレン-2-カルボン酸メチル
  • メチル 8-オキソ-4-オキサ-2-チア-9-アザトリシクロ[8.4.0.03,7]テトラデカ-1(14),3(7),5,10,12-ペンタエン-5-カルボキシラート
  • methyl 8-oxo-4-oxa-2-thia-9-azatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),5,10,12-pentaene-5-carboxylate
Other name (2):
  • 10-Oxo-9,10-dihydro-3-oxa-4-thia-9-azabenz[f]azulene-2-carboxylic acid methyl ester
  • 9,10-Dihydro-10-oxo-3-oxa-4-thia-9-azabenzo[f]azulene-2-carboxylic acid methyl ester
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