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

Systemtic Name: 1-(4-tert-butylphenyl)-5-phenyl-3-propyl-pyrazole-4-carboxylic acid Openeye Name: 1-(4-tert-butylphenyl)-5-phenyl-3-propyl-pyrazole-4-carboxylic acid CAS Name: 1-(4-tert-butylphenyl)-5-phenyl-3-propyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-tert-butylphenyl)-5-phenyl-3-propylpyrazole-4-carboxylic acid Traditional Name: 1-(4-tert-butylphenyl)-5-phenyl-3-propyl-pyrazole-4-carboxylic acid Formula: C23H26N2O2 MolecularWeight: 362.46474

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1C(=O)O)C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCCC1=NN(C(=C1C(=O)O)C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H26N2O2/c1-5-9-19-20(22(26)27)21(16-10-7-6-8-11-16)25(24-19)18-14-12-17(13-15-18)23(2,3)4/h6-8,10-15H,5,9H2,1-4H3,(H,26,27)