1-(4-tert-butylphenyl)-3-(2-phenylpropyl)-5-propan-2-yl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(4-tert-butylphenyl)-3-(2-phenylpropyl)-5-propan-2-yl-pyrazole-4-carboxylic acid Openeye Name: 1-(4-tert-butylphenyl)-5-isopropyl-3-(2-phenylpropyl)pyrazole-4-carboxylic acid CAS Name: 1-(4-tert-butylphenyl)-3-(2-phenylpropyl)-5-propan-2-yl-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-tert-butylphenyl)-3-(2-phenylpropyl)-5-propan-2-ylpyrazole-4-carboxylic acid Traditional Name: 1-(4-tert-butylphenyl)-5-isopropyl-3-(2-phenylpropyl)pyrazole-4-carboxylic acid Formula: C26H32N2O2 MolecularWeight: 404.54448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NN1C2=CC=C(C=C2)C(C)(C)C)CC(C)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)C1=C(C(=NN1C2=CC=C(C=C2)C(C)(C)C)CC(C)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C26H32N2O2/c1-17(2)24-23(25(29)30)22(16-18(3)19-10-8-7-9-11-19)27-28(24)21-14-12-20(13-15-21)26(4,5)6/h7-15,17-18H,16H2,1-6H3,(H,29,30)