6-[1-(4-methylphenyl)pyrazol-4-yl]pyridine-3-carboxylic acid

Systemtic Name: 6-[1-(4-methylphenyl)pyrazol-4-yl]pyridine-3-carboxylic acid Openeye Name: 6-[1-(p-tolyl)pyrazol-4-yl]pyridine-3-carboxylic acid CAS Name: 6-[1-(4-methylphenyl)-4-pyrazolyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[1-(4-methylphenyl)pyrazol-4-yl]pyridine-3-carboxylic acid Traditional Name: 6-[1-(p-tolyl)pyrazol-4-yl]nicotinic acid Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C=N2)C3=NC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C=N2)C3=NC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H13N3O2/c1-11-2-5-14(6-3-11)19-10-13(9-18-19)15-7-4-12(8-17-15)16(20)21/h2-10H,1H3,(H,20,21)