(2-oxidanylidene-2-pyridin-2-yl-ethyl) 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate

Systemtic Name: (2-oxidanylidene-2-pyridin-2-yl-ethyl) 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate Openeye Name: [2-oxo-2-(2-pyridyl)ethyl] 2-(p-tolyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylic acid [2-oxo-2-(2-pyridinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyridin-2-ylethyl) 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate Traditional Name: 2-(p-tolyl)-3H-benzimidazole-5-carboxylic acid [2-keto-2-(2-pyridyl)ethyl] ester Formula: C22H17N3O3 MolecularWeight: 371.38868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(=O)OCC(=O)C4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(=O)OCC(=O)C4=CC=CC=N4

InChI

InChI=1S/C22H17N3O3/c1-14-5-7-15(8-6-14)21-24-17-10-9-16(12-19(17)25-21)22(27)28-13-20(26)18-4-2-3-11-23-18/h2-12H,13H2,1H3,(H,24,25)