Chem
J-GLOBAL ID:200907049064158880   Nikkaji number:J1.846.186B

1-Benzyl-5-methyl-4,5-dihydro-1H-azepine-2,3-dicarboxylic acid dimethyl ester

1-ベンジル-5-メチル-4,5-ジヒドロ-1H-アゼピン-2,3-ジカルボン酸ジメチル
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: C18H21NO4
Molecular formula furigana: C18-H21-N-O4
Molecular weight: 315.369
InChI: InChI=1S/C18H21NO4/c1-13-9-10-19(12-14-7-5-4-6-8-14)16(18(21)23-3)15(11-13)17(20)22-2/h4-10,13H,11-12H2,1-3H3
InChI key: AJOMNAFOHJKXTG-UHFFFAOYSA-N
SMILES: COC(=O)C1=C(N(Cc2ccccc2)C=CC(C)C1)C(=O)OC
Systematic name  (3):
  • 1-ベンジル-5-メチル-4,5-ジヒドロ-1H-アゼピン-2,3-ジカルボン酸ジメチル
  • 2,3-ジメチル 1-ベンジル-5-メチル-4,5-ジヒドロ-1H-アゼピン-2,3-ジカルボキシラート
  • 2,3-dimethyl 1-benzyl-5-methyl-4,5-dihydro-1H-azepine-2,3-dicarboxylate
Other name (1):
  • 1-Benzyl-5-methyl-4,5-dihydro-1H-azepine-2,3-dicarboxylic acid dimethyl ester
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