2-(2-methoxyphenyl)-5-[4-(2-methylpropyl)phenyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-(2-methoxyphenyl)-5-[4-(2-methylpropyl)phenyl]pyrazole-3-carboxylic acid Openeye Name: 5-(4-isobutylphenyl)-2-(2-methoxyphenyl)pyrazole-3-carboxylic acid CAS Name: 2-(2-methoxyphenyl)-5-[4-(2-methylpropyl)phenyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-(2-methoxyphenyl)-5-[4-(2-methylpropyl)phenyl]pyrazole-3-carboxylic acid Traditional Name: 5-(4-isobutylphenyl)-2-(2-methoxyphenyl)pyrazole-3-carboxylic acid Formula: C21H22N2O3 MolecularWeight: 350.41098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C2=NN(C(=C2)C(=O)O)C3=CC=CC=C3OC

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C2=NN(C(=C2)C(=O)O)C3=CC=CC=C3OC

InChI

InChI=1S/C21H22N2O3/c1-14(2)12-15-8-10-16(11-9-15)17-13-19(21(24)25)23(22-17)18-6-4-5-7-20(18)26-3/h4-11,13-14H,12H2,1-3H3,(H,24,25)