2-[4-[[4-carboxyoxy-5-(2-oxidanylpropan-2-yl)-2-propyl-imidazol-1-yl]methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[[4-carboxyoxy-5-(2-oxidanylpropan-2-yl)-2-propyl-imidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[4-carboxyoxy-5-(1-hydroxy-1-methyl-ethyl)-2-propyl-imidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[4-carboxyoxy-5-(2-hydroxypropan-2-yl)-2-propyl-1-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[4-carboxyoxy-5-(2-hydroxypropan-2-yl)-2-propylimidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[4-carboxyoxy-5-(1-hydroxy-1-methyl-ethyl)-2-propyl-imidazol-1-yl]methyl]phenyl]benzoic acid Formula: C24H26N2O6 MolecularWeight: 438.47304

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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)OC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C24H26N2O6/c1-4-7-19-25-21(32-23(29)30)20(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)