ethanoic acid; methyl 5-(1H-benzimidazol-2-yl)-2-methyl-6-(4-methylphenyl)pyridine-3-carboxylate

Systemtic Name: ethanoic acid; methyl 5-(1H-benzimidazol-2-yl)-2-methyl-6-(4-methylphenyl)pyridine-3-carboxylate Openeye Name: acetic acid; methyl 5-(1H-benzimidazol-2-yl)-2-methyl-6-(p-tolyl)pyridine-3-carboxylate CAS Name: acetic acid; 5-(1H-benzimidazol-2-yl)-2-methyl-6-(4-methylphenyl)-3-pyridinecarboxylic acid methyl ester IUPAC Name: acetic acid; methyl 5-(1H-benzimidazol-2-yl)-2-methyl-6-(4-methylphenyl)pyridine-3-carboxylate Traditional Name: acetic acid; 5-(1H-benzimidazol-2-yl)-2-methyl-6-(p-tolyl)nicotinic acid methyl ester Formula: C24H23N3O4 MolecularWeight: 417.45712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C=C2C3=NC4=CC=CC=C4N3)C(=O)OC)C.CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C=C2C3=NC4=CC=CC=C4N3)C(=O)OC)C.CC(=O)O

InChI

InChI=1S/C22H19N3O2.C2H4O2/c1-13-8-10-15(11-9-13)20-17(12-16(14(2)23-20)22(26)27-3)21-24-18-6-4-5-7-19(18)25-21;1-2(3)4/h4-12H,1-3H3,(H,24,25);1H3,(H,3,4)