1-(4-tert-butylphenyl)-5-ethyl-3-(2-methylpropyl)pyrazole-4-carboxylic acid

Systemtic Name: 1-(4-tert-butylphenyl)-5-ethyl-3-(2-methylpropyl)pyrazole-4-carboxylic acid Openeye Name: 1-(4-tert-butylphenyl)-5-ethyl-3-isobutyl-pyrazole-4-carboxylic acid CAS Name: 1-(4-tert-butylphenyl)-5-ethyl-3-(2-methylpropyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-tert-butylphenyl)-5-ethyl-3-(2-methylpropyl)pyrazole-4-carboxylic acid Traditional Name: 1-(4-tert-butylphenyl)-5-ethyl-3-isobutyl-pyrazole-4-carboxylic acid Formula: C20H28N2O2 MolecularWeight: 328.44852

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC=C(C=C2)C(C)(C)C)CC(C)C)C(=O)O

Isomeric SMILES

CCC1=C(C(=NN1C2=CC=C(C=C2)C(C)(C)C)CC(C)C)C(=O)O

InChI

InChI=1S/C20H28N2O2/c1-7-17-18(19(23)24)16(12-13(2)3)21-22(17)15-10-8-14(9-11-15)20(4,5)6/h8-11,13H,7,12H2,1-6H3,(H,23,24)