methyl 7-methoxy-2-[(4-pyridin-3-ylphenyl)methyl]-1H-benzimidazole-4-carboxylate

Systemtic Name: methyl 7-methoxy-2-[(4-pyridin-3-ylphenyl)methyl]-1H-benzimidazole-4-carboxylate Openeye Name: methyl 7-methoxy-2-[[4-(3-pyridyl)phenyl]methyl]-1H-benzimidazole-4-carboxylate CAS Name: 7-methoxy-2-[[4-(3-pyridinyl)phenyl]methyl]-1H-benzimidazole-4-carboxylic acid methyl ester IUPAC Name: methyl 7-methoxy-2-[(4-pyridin-3-ylphenyl)methyl]-1H-benzimidazole-4-carboxylate Traditional Name: 7-methoxy-2-[4-(3-pyridyl)benzyl]-1H-benzimidazole-4-carboxylic acid methyl ester Formula: C22H19N3O3 MolecularWeight: 373.40456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C(=O)OC)N=C(N2)CC3=CC=C(C=C3)C4=CN=CC=C4

Isomeric SMILES

COC1=C2C(=C(C=C1)C(=O)OC)N=C(N2)CC3=CC=C(C=C3)C4=CN=CC=C4

InChI

InChI=1S/C22H19N3O3/c1-27-18-10-9-17(22(26)28-2)20-21(18)25-19(24-20)12-14-5-7-15(8-6-14)16-4-3-11-23-13-16/h3-11,13H,12H2,1-2H3,(H,24,25)