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

Systemtic Name: methyl 2-[4-[[2-ethyl-6-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[[2-ethyl-6-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]phenyl]benzoate CAS Name: 2-[4-[[2-ethyl-6-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1-benzimidazolyl]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[2-ethyl-6-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]phenyl]benzoate Traditional Name: 2-[4-[[2-ethyl-6-(6-keto-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]phenyl]benzoic acid methyl ester Formula: C28H26N4O3 MolecularWeight: 466.53104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC)C=C(C=C2)C5=NNC(=O)CC5

Isomeric SMILES

CCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC)C=C(C=C2)C5=NNC(=O)CC5

InChI

InChI=1S/C28H26N4O3/c1-3-26-29-24-13-12-20(23-14-15-27(33)31-30-23)16-25(24)32(26)17-18-8-10-19(11-9-18)21-6-4-5-7-22(21)28(34)35-2/h4-13,16H,3,14-15,17H2,1-2H3,(H,31,33)