2-[4-[[2-butyl-4-methyl-6-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[[2-butyl-4-methyl-6-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[2-butyl-4-methyl-6-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[2-butyl-4-methyl-6-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1-benzimidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[2-butyl-4-methyl-6-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[2-butyl-6-(6-keto-4,5-dihydro-1H-pyridazin-3-yl)-4-methyl-benzimidazol-1-yl]methyl]phenyl]benzoic acid Formula: C30H30N4O3 MolecularWeight: 494.5842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=C(C=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5=NNC(=O)CC5)C

Isomeric SMILES

CCCCC1=NC2=C(C=C(C=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5=NNC(=O)CC5)C

InChI

InChI=1S/C30H30N4O3/c1-3-4-9-27-31-29-19(2)16-22(25-14-15-28(35)33-32-25)17-26(29)34(27)18-20-10-12-21(13-11-20)23-7-5-6-8-24(23)30(36)37/h5-8,10-13,16-17H,3-4,9,14-15,18H2,1-2H3,(H,33,35)(H,36,37)