Chem
J-GLOBAL ID:200907001119153715   Nikkaji number:J413.167C

3-[α-Hydroxy-3-[2-(7-chloro-2-quinolinyl)ethenyl]benzyl]benzoic acid sodium salt

3-[α-ヒドロキシ-3-[2-(7-クロロ-2-キノリニル)エテニル]ベンジル]安息香酸ナトリウム
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: C25H17ClNNaO3
Molecular formula furigana: C25-H17-CL-N-NA-O3
Molecular weight: 437.850
InChI: InChI=1S/C25H18ClNO3.Na/c26-21-10-8-17-9-12-22(27-23(17)15-21)11-7-16-3-1-4-18(13-16)24(28)19-5-2-6-20(14-19)25(29)30;/h1-15,24,28H,(H,29,30);/q;+1/p-1
InChI key: DTIIXAAUJRPHPJ-UHFFFAOYSA-M
SMILES: OC(c1cccc(C=Cc2ccc3ccc(Cl)cc3n2)c1)c1cccc(c1)C(=O)O[Na]
Systematic name  (3):
  • 3-[α-ヒドロキシ-3-[2-(7-クロロ-2-キノリニル)エテニル]ベンジル]安息香酸ナトリウム
  • ナトリウム 3-({3-[2-(7-クロロキノリン-2-イル)エテニル]フェニル}(ヒドロキシ)メチル)ベンゾアート
  • sodium 3-({3-[2-(7-chloroquinolin-2-yl)ethenyl]phenyl}(hydroxy)methyl)benzoate
Other name (1):
  • 3-[α-Hydroxy-3-[2-(7-chloro-2-quinolinyl)ethenyl]benzyl]benzoic acid sodium salt
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