4-[[2-(4-bromophenyl)-4-[(3-phenylphenyl)methoxymethyl]imidazol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[2-(4-bromophenyl)-4-[(3-phenylphenyl)methoxymethyl]imidazol-1-yl]methyl]benzoic acid Openeye Name: 4-[[2-(4-bromophenyl)-4-[(3-phenylphenyl)methoxymethyl]imidazol-1-yl]methyl]benzoic acid CAS Name: 4-[[2-(4-bromophenyl)-4-[(3-phenylphenyl)methoxymethyl]-1-imidazolyl]methyl]benzoic acid IUPAC Name: 4-[[2-(4-bromophenyl)-4-[(3-phenylphenyl)methoxymethyl]imidazol-1-yl]methyl]benzoic acid Traditional Name: 4-[[2-(4-bromophenyl)-4-[(3-phenylbenzyl)oxymethyl]imidazol-1-yl]methyl]benzoic acid Formula: C31H25BrN2O3 MolecularWeight: 553.4458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CC=C2)COCC3=CN(C(=N3)C4=CC=C(C=C4)Br)CC5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CC=C2)COCC3=CN(C(=N3)C4=CC=C(C=C4)Br)CC5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C31H25BrN2O3/c32-28-15-13-25(14-16-28)30-33-29(19-34(30)18-22-9-11-26(12-10-22)31(35)36)21-37-20-23-5-4-8-27(17-23)24-6-2-1-3-7-24/h1-17,19H,18,20-21H2,(H,35,36)