5-tert-butyl-4-methyl-1-(2-methylphenyl)pyrazole-3-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C(=N2)C(=O)O)C)C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C(=N2)C(=O)O)C)C(C)(C)C

InChI

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