2-[4-[[4-(1,5-dimethyl-4-phenyl-imidazol-2-yl)-1-methyl-2-propyl-benzimidazol-1-ium-1-yl]methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[[4-(1,5-dimethyl-4-phenyl-imidazol-2-yl)-1-methyl-2-propyl-benzimidazol-1-ium-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[4-(1,5-dimethyl-4-phenyl-imidazol-2-yl)-1-methyl-2-propyl-benzimidazol-1-ium-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[4-(1,5-dimethyl-4-phenyl-2-imidazolyl)-1-methyl-2-propyl-1-benzimidazol-1-iumyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[4-(1,5-dimethyl-4-phenylimidazol-2-yl)-1-methyl-2-propylbenzimidazol-1-ium-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[4-(1,5-dimethyl-4-phenyl-imidazol-2-yl)-1-methyl-2-propyl-benzimidazol-1-ium-1-yl]methyl]phenyl]benzoic acid Formula: C36H35N4O2+ MolecularWeight: 555.6887

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=CC=C2[N+]1(C)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5=NC(=C(N5C)C)C6=CC=CC=C6

Isomeric SMILES

CCCC1=NC2=C(C=CC=C2[N+]1(C)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5=NC(=C(N5C)C)C6=CC=CC=C6

InChI

InChI=1S/C36H34N4O2/c1-5-12-32-37-34-30(35-38-33(24(2)39(35)3)27-13-7-6-8-14-27)17-11-18-31(34)40(32,4)23-25-19-21-26(22-20-25)28-15-9-10-16-29(28)36(41)42/h6-11,13-22H,5,12,23H2,1-4H3/p+1