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

Systemtic Name: ethanoic acid; methyl 5-(1H-benzimidazol-2-yl)-6-(4-chlorophenyl)-2-methyl-pyridine-3-carboxylate Openeye Name: acetic acid; methyl 5-(1H-benzimidazol-2-yl)-6-(4-chlorophenyl)-2-methyl-pyridine-3-carboxylate CAS Name: acetic acid; 5-(1H-benzimidazol-2-yl)-6-(4-chlorophenyl)-2-methyl-3-pyridinecarboxylic acid methyl ester IUPAC Name: acetic acid; methyl 5-(1H-benzimidazol-2-yl)-6-(4-chlorophenyl)-2-methylpyridine-3-carboxylate Traditional Name: acetic acid; 5-(1H-benzimidazol-2-yl)-6-(4-chlorophenyl)-2-methyl-nicotinic acid methyl ester Formula: C23H20ClN3O4 MolecularWeight: 437.8756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)C2=CC=C(C=C2)Cl)C3=NC4=CC=CC=C4N3)C(=O)OC.CC(=O)O

Isomeric SMILES

CC1=C(C=C(C(=N1)C2=CC=C(C=C2)Cl)C3=NC4=CC=CC=C4N3)C(=O)OC.CC(=O)O

InChI

InChI=1S/C21H16ClN3O2.C2H4O2/c1-12-15(21(26)27-2)11-16(19(23-12)13-7-9-14(22)10-8-13)20-24-17-5-3-4-6-18(17)25-20;1-2(3)4/h3-11H,1-2H3,(H,24,25);1H3,(H,3,4)