2-[[2-[1-ethoxycarbonyl-4-(4-methylphenyl)piperidin-4-yl]imidazol-1-yl]methyl]benzoic acid

Systemtic Name: 2-[[2-[1-ethoxycarbonyl-4-(4-methylphenyl)piperidin-4-yl]imidazol-1-yl]methyl]benzoic acid Openeye Name: 2-[[2-[1-ethoxycarbonyl-4-(p-tolyl)-4-piperidyl]imidazol-1-yl]methyl]benzoic acid CAS Name: 2-[[2-[1-ethoxycarbonyl-4-(4-methylphenyl)-4-piperidinyl]-1-imidazolyl]methyl]benzoic acid IUPAC Name: 2-[[2-[1-ethoxycarbonyl-4-(4-methylphenyl)piperidin-4-yl]imidazol-1-yl]methyl]benzoic acid Traditional Name: 2-[[2-[1-carbethoxy-4-(p-tolyl)-4-piperidyl]imidazol-1-yl]methyl]benzoic acid Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)(C2=CC=C(C=C2)C)C3=NC=CN3CC4=CC=CC=C4C(=O)O

Isomeric SMILES

CCOC(=O)N1CCC(CC1)(C2=CC=C(C=C2)C)C3=NC=CN3CC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C26H29N3O4/c1-3-33-25(32)28-15-12-26(13-16-28,21-10-8-19(2)9-11-21)24-27-14-17-29(24)18-20-6-4-5-7-22(20)23(30)31/h4-11,14,17H,3,12-13,15-16,18H2,1-2H3,(H,30,31)