5-(4-tert-butylphenyl)-1-(4-methylphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 5-(4-tert-butylphenyl)-1-(4-methylphenyl)pyrazole-3-carboxylic acid Openeye Name: 5-(4-tert-butylphenyl)-1-(p-tolyl)pyrazole-3-carboxylic acid CAS Name: 5-(4-tert-butylphenyl)-1-(4-methylphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 5-(4-tert-butylphenyl)-1-(4-methylphenyl)pyrazole-3-carboxylic acid Traditional Name: 5-(4-tert-butylphenyl)-1-(p-tolyl)pyrazole-3-carboxylic acid Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O2/c1-14-5-11-17(12-6-14)23-19(13-18(22-23)20(24)25)15-7-9-16(10-8-15)21(2,3)4/h5-13H,1-4H3,(H,24,25)