Chem
J-GLOBAL ID:200907051473238873   Nikkaji number:J2.585.961H

(aS)-β-Isopropyl-6,7-dihydro-5H-dibenzo[c,e]azepine-6-propanoic acid methyl ester

(aS)-β-イソプロピル-6,7-ジヒドロ-5H-ジベンゾ[c,e]アゼピン-6-プロパン酸メチル
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: C21H25NO2
Molecular formula furigana: C21-H25-N-O2
Molecular weight: 323.436
InChI: InChI=1S/C21H25NO2/c1-15(2)20(12-21(23)24-3)22-13-16-8-4-6-10-18(16)19-11-7-5-9-17(19)14-22/h4-11,15,20H,12-14H2,1-3H3
InChI key: KQEKKKKALXAJHV-UHFFFAOYSA-N
SMILES: COC(=O)CC(C(C)C)N1Cc2ccccc2c2ccccc2C1
Systematic name  (1):
  • (aS)-β-イソプロピル-6,7-ジヒドロ-5H-ジベンゾ[c,e]アゼピン-6-プロパン酸メチル
Other name (1):
  • (aS)-β-Isopropyl-6,7-dihydro-5H-dibenzo[c,e]azepine-6-propanoic acid methyl ester
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