4-(4-methylphenyl)carbonylpyridine-3-carboxylic acid

Systemtic Name: 4-(4-methylphenyl)carbonylpyridine-3-carboxylic acid Openeye Name: 4-(4-methylbenzoyl)pyridine-3-carboxylic acid CAS Name: 4-[(4-methylphenyl)-oxomethyl]-3-pyridinecarboxylic acid IUPAC Name: 4-(4-methylbenzoyl)pyridine-3-carboxylic acid Traditional Name: 4-p-toluoylnicotinic acid Formula: C14H11NO3 MolecularWeight: 241.24204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11NO3/c1-9-2-4-10(5-3-9)13(16)11-6-7-15-8-12(11)14(17)18/h2-8H,1H3,(H,17,18)