Chem
J-GLOBAL ID:201207093653515778   Nikkaji number:J3.066.084F

8-(3-Fluoropropyl)-3-[4-(123I)iodophenyl]-8-azabicyclo[3.2.1]octane-2-carboxylic acid methyl ester

8-(3-フルオロプロピル)-3-[4-(123I)ヨードフェニル]-8-アザビシクロ[3.2.1]オクタン-2-カルボン酸メチル
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: C18H23F[123I]NO2
Molecular formula furigana: C18-H23-F-I-N-O2
Molecular weight: 427.291
InChI: InChI=1S/C18H23FINO2/c1-23-18(22)17-15(12-3-5-13(20)6-4-12)11-14-7-8-16(17)21(14)10-2-9-19/h3-6,14-17H,2,7-11H2,1H3/i20-4
InChI key: HXWLAJVUJSVENX-BMILMZPDSA-N
SMILES: COC(=O)C1C2CCC(CC1c1ccc([123I])cc1)N2CCCF
Systematic name  (3):
  • 8-(3-フルオロプロピル)-3-[4-(123I)ヨードフェニル]-8-アザビシクロ[3.2.1]オクタン-2-カルボン酸メチル
  • メチル 8-(3-フルオロプロピル)-3-[4-(123I)ヨードフェニル]-8-アザビシクロ[3.2.1]オクタン-2-カルボキシラート
  • methyl 8-(3-fluoropropyl)-3-[4-(123I)iodophenyl]-8-azabicyclo[3.2.1]octane-2-carboxylate
Other name (1):
  • 8-(3-Fluoropropyl)-3-[4-(123I)iodophenyl]-8-azabicyclo[3.2.1]octane-2-carboxylic acid methyl ester
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