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

Systemtic Name: 1-(3,4-dimethylphenyl)-5-propyl-3-pyridin-4-yl-pyrazole-4-carboxylic acid Openeye Name: 1-(3,4-dimethylphenyl)-5-propyl-3-(4-pyridyl)pyrazole-4-carboxylic acid CAS Name: 1-(3,4-dimethylphenyl)-5-propyl-3-pyridin-4-yl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3,4-dimethylphenyl)-5-propyl-3-pyridin-4-ylpyrazole-4-carboxylic acid Traditional Name: 1-(3,4-dimethylphenyl)-5-propyl-3-(4-pyridyl)pyrazole-4-carboxylic acid Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O2/c1-4-5-17-18(20(24)25)19(15-8-10-21-11-9-15)22-23(17)16-7-6-13(2)14(3)12-16/h6-12H,4-5H2,1-3H3,(H,24,25)