3-[[4-(2-cyanophenyl)phenyl]methyl]-2-methoxy-benzimidazole-4-carboxylate

Systemtic Name: 3-[[4-(2-cyanophenyl)phenyl]methyl]-2-methoxy-benzimidazole-4-carboxylate Openeye Name: 3-[[4-(2-cyanophenyl)phenyl]methyl]-2-methoxy-benzimidazole-4-carboxylate CAS Name: 3-[[4-(2-cyanophenyl)phenyl]methyl]-2-methoxy-4-benzimidazolecarboxylate IUPAC Name: 3-[[4-(2-cyanophenyl)phenyl]methyl]-2-methoxybenzimidazole-4-carboxylate Traditional Name: 3-[4-(2-cyanophenyl)benzyl]-2-methoxy-benzimidazole-4-carboxylate Formula: C23H16N3O3- MolecularWeight: 382.39144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C#N)C(=O)[O-]

Isomeric SMILES

COC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C#N)C(=O)[O-]

InChI

InChI=1S/C23H17N3O3/c1-29-23-25-20-8-4-7-19(22(27)28)21(20)26(23)14-15-9-11-16(12-10-15)18-6-3-2-5-17(18)13-24/h2-12H,14H2,1H3,(H,27,28)/p-1