1-tert-butyl-3-(2,5-dimethylphenyl)pyrazole-4-carboxylic acid

Systemtic Name: 1-tert-butyl-3-(2,5-dimethylphenyl)pyrazole-4-carboxylic acid Openeye Name: 1-tert-butyl-3-(2,5-dimethylphenyl)pyrazole-4-carboxylic acid CAS Name: 1-tert-butyl-3-(2,5-dimethylphenyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-tert-butyl-3-(2,5-dimethylphenyl)pyrazole-4-carboxylic acid Traditional Name: 1-tert-butyl-3-(2,5-dimethylphenyl)pyrazole-4-carboxylic acid Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NN(C=C2C(=O)O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NN(C=C2C(=O)O)C(C)(C)C

InChI

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