3-[4-ethoxycarbonyl-2-(4-methoxyphenyl)-5-methyl-imidazol-1-yl]benzoic acid

Systemtic Name: 3-[4-ethoxycarbonyl-2-(4-methoxyphenyl)-5-methyl-imidazol-1-yl]benzoic acid Openeye Name: 3-[4-ethoxycarbonyl-2-(4-methoxyphenyl)-5-methyl-imidazol-1-yl]benzoic acid CAS Name: 3-[4-ethoxycarbonyl-2-(4-methoxyphenyl)-5-methyl-1-imidazolyl]benzoic acid IUPAC Name: 3-[4-ethoxycarbonyl-2-(4-methoxyphenyl)-5-methylimidazol-1-yl]benzoic acid Traditional Name: 3-[4-carbethoxy-2-(4-methoxyphenyl)-5-methyl-imidazol-1-yl]benzoic acid Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=N1)C2=CC=C(C=C2)OC)C3=CC=CC(=C3)C(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=N1)C2=CC=C(C=C2)OC)C3=CC=CC(=C3)C(=O)O)C

InChI

InChI=1S/C21H20N2O5/c1-4-28-21(26)18-13(2)23(16-7-5-6-15(12-16)20(24)25)19(22-18)14-8-10-17(27-3)11-9-14/h5-12H,4H2,1-3H3,(H,24,25)