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

Systemtic Name: 2-[4-[(5-ethoxycarbonyl-4-methyl-2-propyl-imidazol-1-yl)methyl]phenyl]benzoic acid Openeye Name: 2-[4-[(5-ethoxycarbonyl-4-methyl-2-propyl-imidazol-1-yl)methyl]phenyl]benzoic acid CAS Name: 2-[4-[(5-ethoxycarbonyl-4-methyl-2-propyl-1-imidazolyl)methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[(5-ethoxycarbonyl-4-methyl-2-propylimidazol-1-yl)methyl]phenyl]benzoic acid Traditional Name: 2-[4-[(5-carbethoxy-4-methyl-2-propyl-imidazol-1-yl)methyl]phenyl]benzoic acid Formula: C24H26N2O4 MolecularWeight: 406.47424

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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(=O)OCC)C

Isomeric SMILES

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

InChI

InChI=1S/C24H26N2O4/c1-4-8-21-25-16(3)22(24(29)30-5-2)26(21)15-17-11-13-18(14-12-17)19-9-6-7-10-20(19)23(27)28/h6-7,9-14H,4-5,8,15H2,1-3H3,(H,27,28)