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

Systemtic Name: 1-(4-tert-butylphenyl)-3-phenethyl-5-propan-2-yl-pyrazole-4-carboxylic acid Openeye Name: 1-(4-tert-butylphenyl)-5-isopropyl-3-phenethyl-pyrazole-4-carboxylic acid CAS Name: 1-(4-tert-butylphenyl)-3-phenethyl-5-propan-2-yl-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-tert-butylphenyl)-3-phenethyl-5-propan-2-ylpyrazole-4-carboxylic acid Traditional Name: 1-(4-tert-butylphenyl)-5-isopropyl-3-phenethyl-pyrazole-4-carboxylic acid Formula: C25H30N2O2 MolecularWeight: 390.5179

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NN1C2=CC=C(C=C2)C(C)(C)C)CCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)C1=C(C(=NN1C2=CC=C(C=C2)C(C)(C)C)CCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C25H30N2O2/c1-17(2)23-22(24(28)29)21(16-11-18-9-7-6-8-10-18)26-27(23)20-14-12-19(13-15-20)25(3,4)5/h6-10,12-15,17H,11,16H2,1-5H3,(H,28,29)