3-[[4-(2-carboxyphenyl)phenyl]methyl]-5-ethyl-2-propyl-imidazole-4-carboxylic acid

Systemtic Name: 3-[[4-(2-carboxyphenyl)phenyl]methyl]-5-ethyl-2-propyl-imidazole-4-carboxylic acid Openeye Name: 3-[[4-(2-carboxyphenyl)phenyl]methyl]-5-ethyl-2-propyl-imidazole-4-carboxylic acid CAS Name: 3-[[4-(2-carboxyphenyl)phenyl]methyl]-5-ethyl-2-propyl-4-imidazolecarboxylic acid IUPAC Name: 3-[[4-(2-carboxyphenyl)phenyl]methyl]-5-ethyl-2-propylimidazole-4-carboxylic acid Traditional Name: 3-[4-(2-carboxyphenyl)benzyl]-5-ethyl-2-propyl-imidazole-4-carboxylic acid Formula: C23H24N2O4 MolecularWeight: 392.44766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C(=O)O)CC

Isomeric SMILES

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C(=O)O)CC

InChI

InChI=1S/C23H24N2O4/c1-3-7-20-24-19(4-2)21(23(28)29)25(20)14-15-10-12-16(13-11-15)17-8-5-6-9-18(17)22(26)27/h5-6,8-13H,3-4,7,14H2,1-2H3,(H,26,27)(H,28,29)