4-[[4-(2,2-dimethyl-1-phenylmethoxy-propyl)imidazol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[4-(2,2-dimethyl-1-phenylmethoxy-propyl)imidazol-1-yl]methyl]benzoic acid Openeye Name: 4-[[4-(1-benzyloxy-2,2-dimethyl-propyl)imidazol-1-yl]methyl]benzoic acid CAS Name: 4-[[4-(2,2-dimethyl-1-phenylmethoxypropyl)-1-imidazolyl]methyl]benzoic acid IUPAC Name: 4-[[4-(2,2-dimethyl-1-phenylmethoxypropyl)imidazol-1-yl]methyl]benzoic acid Traditional Name: 4-[[4-(1-benzoxy-2,2-dimethyl-propyl)imidazol-1-yl]methyl]benzoic acid Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C1=CN(C=N1)CC2=CC=C(C=C2)C(=O)O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(C1=CN(C=N1)CC2=CC=C(C=C2)C(=O)O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H26N2O3/c1-23(2,3)21(28-15-18-7-5-4-6-8-18)20-14-25(16-24-20)13-17-9-11-19(12-10-17)22(26)27/h4-12,14,16,21H,13,15H2,1-3H3,(H,26,27)