Chem
J-GLOBAL ID:200907002063474196   Nikkaji number:J392.181F

α,α-Dimethyl-1-(4-chlorobenzyl)-5-fluoro-1H-indole-2-propanoic acid methyl ester

α,α-ジメチル-1-(4-クロロベンジル)-5-フルオロ-1H-インドール-2-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: C21H21ClFNO2
Molecular formula furigana: C21-H21-CL-F-N-O2
Molecular weight: 373.850
InChI: InChI=1S/C21H21ClFNO2/c1-21(2,20(25)26-3)12-18-11-15-10-17(23)8-9-19(15)24(18)13-14-4-6-16(22)7-5-14/h4-11H,12-13H2,1-3H3
InChI key: RUOHAVDLXZDISR-UHFFFAOYSA-N
SMILES: COC(=O)C(C)(C)Cc1cc2cc(F)ccc2n1Cc1ccc(Cl)cc1
Systematic name  (3):
  • α,α-ジメチル-1-(4-クロロベンジル)-5-フルオロ-1H-インドール-2-プロパン酸メチル
  • メチル 3-{1-[(4-クロロフェニル)メチル]-5-フルオロ-1H-インドール-2-イル}-2,2-ジメチルプロパノアート
  • methyl 3-{1-[(4-chlorophenyl)methyl]-5-fluoro-1H-indol-2-yl}-2,2-dimethylpropanoate
Other name (1):
  • α,α-Dimethyl-1-(4-chlorobenzyl)-5-fluoro-1H-indole-2-propanoic acid methyl ester
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