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

Systemtic Name: 1-(4-tert-butylphenyl)-5-phenyl-3-(2-phenylpropyl)pyrazole-4-carboxylic acid Openeye Name: 1-(4-tert-butylphenyl)-5-phenyl-3-(2-phenylpropyl)pyrazole-4-carboxylic acid CAS Name: 1-(4-tert-butylphenyl)-5-phenyl-3-(2-phenylpropyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-tert-butylphenyl)-5-phenyl-3-(2-phenylpropyl)pyrazole-4-carboxylic acid Traditional Name: 1-(4-tert-butylphenyl)-5-phenyl-3-(2-phenylpropyl)pyrazole-4-carboxylic acid Formula: C29H30N2O2 MolecularWeight: 438.5607

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NN(C(=C1C(=O)O)C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C)C4=CC=CC=C4

Isomeric SMILES

CC(CC1=NN(C(=C1C(=O)O)C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C29H30N2O2/c1-20(21-11-7-5-8-12-21)19-25-26(28(32)33)27(22-13-9-6-10-14-22)31(30-25)24-17-15-23(16-18-24)29(2,3)4/h5-18,20H,19H2,1-4H3,(H,32,33)