1-tert-butyl-3-(4-ethylphenyl)pyrazole-4-carboxylic acid

Systemtic Name: 1-tert-butyl-3-(4-ethylphenyl)pyrazole-4-carboxylic acid Openeye Name: 1-tert-butyl-3-(4-ethylphenyl)pyrazole-4-carboxylic acid CAS Name: 1-tert-butyl-3-(4-ethylphenyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-tert-butyl-3-(4-ethylphenyl)pyrazole-4-carboxylic acid Traditional Name: 1-tert-butyl-3-(4-ethylphenyl)pyrazole-4-carboxylic acid Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(C=C2C(=O)O)C(C)(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(C=C2C(=O)O)C(C)(C)C

InChI

InChI=1S/C16H20N2O2/c1-5-11-6-8-12(9-7-11)14-13(15(19)20)10-18(17-14)16(2,3)4/h6-10H,5H2,1-4H3,(H,19,20)