Chem
J-GLOBAL ID:200907000529635320   Nikkaji number:J558.098F

4-[(Pyrrolidin-1-yl)methyl]benzeneacetic acid [(2,3-dihydro-1,4-benzodioxin)-2-yl]methyl ester

4-[(ピロリジン-1-イル)メチル]ベンゼン酢酸[(2,3-ジヒドロ-1,4-ベンゾジオキシン)-2-イル]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: C22H25NO4
Molecular formula furigana: C22-H25-N-O4
Molecular weight: 367.445
InChI: InChI=1S/C22H25NO4/c24-22(26-16-19-15-25-20-5-1-2-6-21(20)27-19)13-17-7-9-18(10-8-17)14-23-11-3-4-12-23/h1-2,5-10,19H,3-4,11-16H2
InChI key: BIDISVPHVQYWLL-UHFFFAOYSA-N
SMILES: O=C(Cc1ccc(CN2CCCC2)cc1)OCC1COc2ccccc2O1
Systematic name  (3):
  • 4-[(ピロリジン-1-イル)メチル]ベンゼン酢酸[(2,3-ジヒドロ-1,4-ベンゾジオキシン)-2-イル]メチル
  • (2,3-ジヒドロ-1,4-ベンゾジオキシン-2-イル)メチル 2-{4-[(ピロリジン-1-イル)メチル]フェニル}アセタート
  • (2,3-dihydro-1,4-benzodioxin-2-yl)methyl 2-{4-[(pyrrolidin-1-yl)methyl]phenyl}acetate
Other name (1):
  • 4-[(Pyrrolidin-1-yl)methyl]benzeneacetic acid [(2,3-dihydro-1,4-benzodioxin)-2-yl]methyl ester
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