Chem
J-GLOBAL ID:200907050143478952   Nikkaji number:J2.629.613G

Acetic acid 3-isopropyl-4-oxo-3,4-dihydro-1H-2-benzopyran-1β-yl ester

酢酸3-イソプロピル-4-オキソ-3,4-ジヒドロ-1H-2-ベンゾピラン-1β-イル
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: C14H16O4
Molecular formula furigana: C14-H16-O4
Molecular weight: 248.278
InChI: InChI=1S/C14H16O4/c1-8(2)13-12(16)10-6-4-5-7-11(10)14(18-13)17-9(3)15/h4-8,13-14H,1-3H3/t13?,14-/m0/s1
InChI key: CUUNCKHTVYKKEX-KZUDCZAMSA-N
SMILES: CC(C)C1O[C@H](OC(=O)C)c2ccccc2C1=O
Systematic name  (3):
  • 酢酸3-イソプロピル-4-オキソ-3,4-ジヒドロ-1H-2-ベンゾピラン-1β-イル
  • (1R)-4-オキソ-3-(プロパン-2-イル)-3,4-ジヒドロ-1H-2-ベンゾピラン-1-イル アセタート
  • (1R)-4-oxo-3-(propan-2-yl)-3,4-dihydro-1H-2-benzopyran-1-yl acetate
Other name (1):
  • Acetic acid 3-isopropyl-4-oxo-3,4-dihydro-1H-2-benzopyran-1β-yl ester
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