1-(4-tert-butylphenyl)-5-(2,5-dimethylphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 1-(4-tert-butylphenyl)-5-(2,5-dimethylphenyl)pyrazole-3-carboxylic acid Openeye Name: 1-(4-tert-butylphenyl)-5-(2,5-dimethylphenyl)pyrazole-3-carboxylic acid CAS Name: 1-(4-tert-butylphenyl)-5-(2,5-dimethylphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(4-tert-butylphenyl)-5-(2,5-dimethylphenyl)pyrazole-3-carboxylic acid Traditional Name: 1-(4-tert-butylphenyl)-5-(2,5-dimethylphenyl)pyrazole-3-carboxylic acid Formula: C22H24N2O2 MolecularWeight: 348.43816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=CC(=NN2C3=CC=C(C=C3)C(C)(C)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=CC(=NN2C3=CC=C(C=C3)C(C)(C)C)C(=O)O

InChI

InChI=1S/C22H24N2O2/c1-14-6-7-15(2)18(12-14)20-13-19(21(25)26)23-24(20)17-10-8-16(9-11-17)22(3,4)5/h6-13H,1-5H3,(H,25,26)