2-methyl-6-phenyl-pyridine-3-carboxylic acid; 6-phenylpyridine-2,3-dicarboxylic acid

Systemtic Name: 2-methyl-6-phenyl-pyridine-3-carboxylic acid; 6-phenylpyridine-2,3-dicarboxylic acid Openeye Name: 2-methyl-6-phenyl-pyridine-3-carboxylic acid; 6-phenylpyridine-2,3-dicarboxylic acid CAS Name: 2-methyl-6-phenyl-3-pyridinecarboxylic acid; 6-phenylpyridine-2,3-dicarboxylic acid IUPAC Name: 2-methyl-6-phenylpyridine-3-carboxylic acid; 6-phenylpyridine-2,3-dicarboxylic acid Traditional Name: 2-methyl-6-phenyl-nicotinic acid; 6-phenylquinolinic acid Formula: C26H20N2O6 MolecularWeight: 456.4468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C2=CC=CC=C2)C(=O)O.C1=CC=C(C=C1)C2=NC(=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=N1)C2=CC=CC=C2)C(=O)O.C1=CC=C(C=C1)C2=NC(=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C13H9NO4.C13H11NO2/c15-12(16)9-6-7-10(14-11(9)13(17)18)8-4-2-1-3-5-8;1-9-11(13(15)16)7-8-12(14-9)10-5-3-2-4-6-10/h1-7H,(H,15,16)(H,17,18);2-8H,1H3,(H,15,16)