Chem
J-GLOBAL ID:201907010766792700   Nikkaji number:J3.740.502G

4-[1-benzyl-5-(trifluoromethyl)-1,3-benzodiazol-2-yl]-2-methoxyphenol

4-[1-ベンジル-5-(トリフルオロメチル)-1,3-ベンゾジアゾール-2-イル]-2-メトキシフェノール
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: C22H17F3N2O2
Molecular formula furigana: C22-H17-F3-N2-O2
Molecular weight: 398.385
InChI: InChI=1S/C22H17F3N2O2/c1-29-20-11-15(7-10-19(20)28)21-26-17-12-16(22(23,24)25)8-9-18(17)27(21)13-14-5-3-2-4-6-14/h2-12,28H,13H2,1H3
InChI key: AKRLZTLLUJUBGT-UHFFFAOYSA-N
SMILES: c1(c(cc(cc1)c1n(c2c(n1)cc(cc2)C(F)(F)F)Cc1ccccc1)OC)O
Systematic name  (3):
  • 2-メトキシ-4-[1-ベンジル-5-(トリフルオロメチル)-1H-ベンゾイミダゾール-2-イル]フェノール
  • 4-[1-ベンジル-5-(トリフルオロメチル)-1H-1,3-ベンゾジアゾール-2-イル]-2-メトキシフェノール
  • 4-[1-benzyl-5-(trifluoromethyl)-1H-1,3-benzodiazol-2-yl]-2-methoxyphenol
Other name (2):
  • 4-[1-ベンジル-5-(トリフルオロメチル)-1,3-ベンゾジアゾール-2-イル]-2-メトキシフェノール
  • 4-[1-benzyl-5-(trifluoromethyl)-1,3-benzodiazol-2-yl]-2-methoxyphenol
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