4-(3-imidazol-1-ylphenyl)-2,6-dimethyl-1-(2-morpholin-4-ylethyl)-4H-pyridine-3,5-dicarboxylic acid

Systemtic Name: 4-(3-imidazol-1-ylphenyl)-2,6-dimethyl-1-(2-morpholin-4-ylethyl)-4H-pyridine-3,5-dicarboxylic acid Openeye Name: 4-(3-imidazol-1-ylphenyl)-2,6-dimethyl-1-(2-morpholinoethyl)-4H-pyridine-3,5-dicarboxylic acid CAS Name: 4-[3-(1-imidazolyl)phenyl]-2,6-dimethyl-1-[2-(4-morpholinyl)ethyl]-4H-pyridine-3,5-dicarboxylic acid IUPAC Name: 4-(3-imidazol-1-ylphenyl)-2,6-dimethyl-1-(2-morpholin-4-ylethyl)-4H-pyridine-3,5-dicarboxylic acid Traditional Name: 4-(3-imidazol-1-ylphenyl)-2,6-dimethyl-1-(2-morpholinoethyl)-4H-pyridine-3,5-dicarboxylic acid Formula: C24H28N4O5 MolecularWeight: 452.50292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1CCN2CCOCC2)C)C(=O)O)C3=CC(=CC=C3)N4C=CN=C4)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1CCN2CCOCC2)C)C(=O)O)C3=CC(=CC=C3)N4C=CN=C4)C(=O)O

InChI

InChI=1S/C24H28N4O5/c1-16-20(23(29)30)22(18-4-3-5-19(14-18)27-7-6-25-15-27)21(24(31)32)17(2)28(16)9-8-26-10-12-33-13-11-26/h3-7,14-15,22H,8-13H2,1-2H3,(H,29,30)(H,31,32)