1-[[4-(2-carboxyphenyl)phenyl]methyl]-5-(2-oxidanylpropan-2-yl)-2-propyl-imidazole-4-carboxylic acid

Systemtic Name: 1-[[4-(2-carboxyphenyl)phenyl]methyl]-5-(2-oxidanylpropan-2-yl)-2-propyl-imidazole-4-carboxylic acid Openeye Name: 1-[[4-(2-carboxyphenyl)phenyl]methyl]-5-(1-hydroxy-1-methyl-ethyl)-2-propyl-imidazole-4-carboxylic acid CAS Name: 1-[[4-(2-carboxyphenyl)phenyl]methyl]-5-(2-hydroxypropan-2-yl)-2-propyl-4-imidazolecarboxylic acid IUPAC Name: 1-[[4-(2-carboxyphenyl)phenyl]methyl]-5-(2-hydroxypropan-2-yl)-2-propylimidazole-4-carboxylic acid Traditional Name: 1-[4-(2-carboxyphenyl)benzyl]-5-(1-hydroxy-1-methyl-ethyl)-2-propyl-imidazole-4-carboxylic acid Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H26N2O5/c1-4-7-19-25-20(23(29)30)21(24(2,3)31)26(19)14-15-10-12-16(13-11-15)17-8-5-6-9-18(17)22(27)28/h5-6,8-13,31H,4,7,14H2,1-3H3,(H,27,28)(H,29,30)