1-(4-methylphenyl)-5-propyl-3-pyridin-3-yl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(4-methylphenyl)-5-propyl-3-pyridin-3-yl-pyrazole-4-carboxylic acid Openeye Name: 5-propyl-1-(p-tolyl)-3-(3-pyridyl)pyrazole-4-carboxylic acid CAS Name: 1-(4-methylphenyl)-5-propyl-3-(3-pyridinyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-methylphenyl)-5-propyl-3-pyridin-3-ylpyrazole-4-carboxylic acid Traditional Name: 5-propyl-1-(p-tolyl)-3-(3-pyridyl)pyrazole-4-carboxylic acid Formula: C19H19N3O2 MolecularWeight: 321.37306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NN1C2=CC=C(C=C2)C)C3=CN=CC=C3)C(=O)O

Isomeric SMILES

CCCC1=C(C(=NN1C2=CC=C(C=C2)C)C3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C19H19N3O2/c1-3-5-16-17(19(23)24)18(14-6-4-11-20-12-14)21-22(16)15-9-7-13(2)8-10-15/h4,6-12H,3,5H2,1-2H3,(H,23,24)