Chem
J-GLOBAL ID:200907071607333747   Nikkaji number:J751.504I

2-Oxo-6-chloromethyl-2H-1-benzopyran-3-carboxylic acid octyl ester

2-オキソ-6-クロロメチル-2H-1-ベンゾピラン-3-カルボン酸オクチル
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: C19H23ClO4
Molecular formula furigana: C19-H23-CL-O4
Molecular weight: 350.840
InChI: InChI=1S/C19H23ClO4/c1-2-3-4-5-6-7-10-23-18(21)16-12-15-11-14(13-20)8-9-17(15)24-19(16)22/h8-9,11-12H,2-7,10,13H2,1H3
InChI key: QBIUXXRPYQBUDC-UHFFFAOYSA-N
SMILES: CCCCCCCCOC(=O)c1cc2cc(CCl)ccc2oc1=O
Systematic name  (3):
  • 2-オキソ-6-クロロメチル-2H-1-ベンゾピラン-3-カルボン酸オクチル
  • オクチル 6-(クロロメチル)-2-オキソ-2H-クロメン-3-カルボキシラート
  • octyl 6-(chloromethyl)-2-oxo-2H-chromene-3-carboxylate
Other name (1):
  • 2-Oxo-6-chloromethyl-2H-1-benzopyran-3-carboxylic acid octyl ester
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