Chem
J-GLOBAL ID：201007048056590130   Nikkaji number：J2.804.066K

Citalopram aldehyde

シタロプラムアルデヒド
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： C18H14FNO2
Molecular formula furigana： C18-H14-F-N-O2
Molecular weight： 295.313
InChI： InChI=1S/C18H14FNO2/c19-16-5-3-15(4-6-16)18(8-1-9-21)17-7-2-13(11-20)10-14(17)12-22-18/h2-7,9-10H,1,8,12H2
InChI key： BBYAFETUIKMLSF-UHFFFAOYSA-N
SMILES： Fc1ccc(cc1)C1(CCC=O)OCc2cc(ccc12)C#N
Systematic name  (3)：
  • 3-[5-シアノ-1-(4-フルオロフェニル)-1,3-ジヒドロイソベンゾフラン-1-イル]プロパナール
  • 1-(4-フルオロフェニル)-1-(3-オキソプロピル)-1,3-ジヒドロ-2-ベンゾフラン-5-カルボニトリル
  • 1-(4-fluorophenyl)-1-(3-oxopropyl)-1,3-dihydro-2-benzofuran-5-carbonitrile
Other name (3)：
  • 3-[5-Cyano-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-1-yl]propanal
  • Citalopram aldehyde
  • シタロプラムアルデヒド
KEGG COMPOUND： C16612
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