2-[4-[[4-methyl-6-(1-methylimidazol-4-yl)-2-propyl-benzimidazol-1-yl]methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[[4-methyl-6-(1-methylimidazol-4-yl)-2-propyl-benzimidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[4-methyl-6-(1-methylimidazol-4-yl)-2-propyl-benzimidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[4-methyl-6-(1-methyl-4-imidazolyl)-2-propyl-1-benzimidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[4-methyl-6-(1-methylimidazol-4-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[4-methyl-6-(1-methylimidazol-4-yl)-2-propyl-benzimidazol-1-yl]methyl]phenyl]benzoic acid Formula: C29H28N4O2 MolecularWeight: 464.55822

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5=CN(C=N5)C)C

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5=CN(C=N5)C)C

InChI

InChI=1S/C29H28N4O2/c1-4-7-27-31-28-19(2)14-22(25-17-32(3)18-30-25)15-26(28)33(27)16-20-10-12-21(13-11-20)23-8-5-6-9-24(23)29(34)35/h5-6,8-15,17-18H,4,7,16H2,1-3H3,(H,34,35)