1-[3-(imidazol-1-ylmethyl)phenyl]-2,6-dimethyl-4H-pyridine-3,5-dicarboxylic acid

Systemtic Name: 1-[3-(imidazol-1-ylmethyl)phenyl]-2,6-dimethyl-4H-pyridine-3,5-dicarboxylic acid Openeye Name: 1-[3-(imidazol-1-ylmethyl)phenyl]-2,6-dimethyl-4H-pyridine-3,5-dicarboxylic acid CAS Name: 1-[3-(1-imidazolylmethyl)phenyl]-2,6-dimethyl-4H-pyridine-3,5-dicarboxylic acid IUPAC Name: 1-[3-(imidazol-1-ylmethyl)phenyl]-2,6-dimethyl-4H-pyridine-3,5-dicarboxylic acid Traditional Name: 1-[3-(imidazol-1-ylmethyl)phenyl]-2,6-dimethyl-4H-pyridine-3,5-dicarboxylic acid Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(=C(N1C2=CC=CC(=C2)CN3C=CN=C3)C)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(CC(=C(N1C2=CC=CC(=C2)CN3C=CN=C3)C)C(=O)O)C(=O)O

InChI

InChI=1S/C19H19N3O4/c1-12-16(18(23)24)9-17(19(25)26)13(2)22(12)15-5-3-4-14(8-15)10-21-7-6-20-11-21/h3-8,11H,9-10H2,1-2H3,(H,23,24)(H,25,26)