1-(3,4-dimethylphenyl)-5-(4-propan-2-ylphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 1-(3,4-dimethylphenyl)-5-(4-propan-2-ylphenyl)pyrazole-3-carboxylic acid Openeye Name: 1-(3,4-dimethylphenyl)-5-(4-isopropylphenyl)pyrazole-3-carboxylic acid CAS Name: 1-(3,4-dimethylphenyl)-5-(4-propan-2-ylphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(3,4-dimethylphenyl)-5-(4-propan-2-ylphenyl)pyrazole-3-carboxylic acid Traditional Name: 1-(3,4-dimethylphenyl)-5-p-cumenyl-pyrazole-3-carboxylic acid Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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