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

Systemtic Name: 3-[[4-(2-carboxyphenyl)phenyl]methyl]-2-ethyl-5-(2-oxidanylpropan-2-yl)imidazole-4-carboxylic acid Openeye Name: 3-[[4-(2-carboxyphenyl)phenyl]methyl]-2-ethyl-5-(1-hydroxy-1-methyl-ethyl)imidazole-4-carboxylic acid CAS Name: 3-[[4-(2-carboxyphenyl)phenyl]methyl]-2-ethyl-5-(2-hydroxypropan-2-yl)-4-imidazolecarboxylic acid IUPAC Name: 3-[[4-(2-carboxyphenyl)phenyl]methyl]-2-ethyl-5-(2-hydroxypropan-2-yl)imidazole-4-carboxylic acid Traditional Name: 3-[4-(2-carboxyphenyl)benzyl]-2-ethyl-5-(1-hydroxy-1-methyl-ethyl)imidazole-4-carboxylic acid Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C(=O)O)C(C)(C)O

Isomeric SMILES

CCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C(=O)O)C(C)(C)O

InChI

InChI=1S/C23H24N2O5/c1-4-18-24-20(23(2,3)30)19(22(28)29)25(18)13-14-9-11-15(12-10-14)16-7-5-6-8-17(16)21(26)27/h5-12,30H,4,13H2,1-3H3,(H,26,27)(H,28,29)