2-[4-[[2-butyl-6-(1-methyl-4,5-dihydroimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[[2-butyl-6-(1-methyl-4,5-dihydroimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[2-butyl-6-(1-methyl-4,5-dihydroimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[2-butyl-6-(1-methyl-4,5-dihydroimidazol-2-yl)-1-benzimidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[2-butyl-6-(1-methyl-4,5-dihydroimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[2-butyl-6-(1-methyl-2-imidazolin-2-yl)benzimidazol-1-yl]methyl]phenyl]benzoic acid Formula: C29H30N4O2 MolecularWeight: 466.5741

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C=C(C=C2)C5=NCCN5C

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C=C(C=C2)C5=NCCN5C

InChI

InChI=1S/C29H30N4O2/c1-3-4-9-27-31-25-15-14-22(28-30-16-17-32(28)2)18-26(25)33(27)19-20-10-12-21(13-11-20)23-7-5-6-8-24(23)29(34)35/h5-8,10-15,18H,3-4,9,16-17,19H2,1-2H3,(H,34,35)