Chem
J-GLOBAL ID:200907099258147690   Nikkaji number:J715.853J

1-[(2′-Carboxy-1,1′-biphenyl-4-yl)methyl]-2-propyl-1H-imidazole-4,5-dicarboxylic acid

1-[(2′-カルボキシ-1,1′-ビフェニル-4-イル)メチル]-2-プロピル-1H-イミダゾール-4,5-ジカルボン酸
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: C22H20N2O6
Molecular formula furigana: C22-H20-N2-O6
Molecular weight: 408.410
InChI: InChI=1S/C22H20N2O6/c1-2-5-17-23-18(21(27)28)19(22(29)30)24(17)12-13-8-10-14(11-9-13)15-6-3-4-7-16(15)20(25)26/h3-4,6-11H,2,5,12H2,1H3,(H,25,26)(H,27,28)(H,29,30)
InChI key: HFTHXQBUJNFWTN-UHFFFAOYSA-N
SMILES: CCCc1nc(C(=O)O)c(C(=O)O)n1Cc1ccc(cc1)c1ccccc1C(=O)O
Systematic name  (3):
  • 1-[(2′-カルボキシ-1,1′-ビフェニル-4-イル)メチル]-2-プロピル-1H-イミダゾール-4,5-ジカルボン酸
  • 1-({2'-カルボキシ-[1,1'-ビフェニル]-4-イル}メチル)-2-プロピル-1H-イミダゾール-4,5-ジカルボン酸
  • 1-({2'-carboxy-[1,1'-biphenyl]-4-yl}methyl)-2-propyl-1H-imidazole-4,5-dicarboxylic acid
Other name (1):
  • 1-[(2′-Carboxy-1,1′-biphenyl-4-yl)methyl]-2-propyl-1H-imidazole-4,5-dicarboxylic acid
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