1-(4-tert-butylphenyl)-3,5-dimethyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(4-tert-butylphenyl)-3,5-dimethyl-pyrazole-4-carboxylic acid Openeye Name: 1-(4-tert-butylphenyl)-3,5-dimethyl-pyrazole-4-carboxylic acid CAS Name: 1-(4-tert-butylphenyl)-3,5-dimethyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-tert-butylphenyl)-3,5-dimethylpyrazole-4-carboxylic acid Traditional Name: 1-(4-tert-butylphenyl)-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(C)(C)C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(C)(C)C)C)C(=O)O

InChI

InChI=1S/C16H20N2O2/c1-10-14(15(19)20)11(2)18(17-10)13-8-6-12(7-9-13)16(3,4)5/h6-9H,1-5H3,(H,19,20)