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

Systemtic Name: 3-tert-butyl-5-chloranyl-1-(2-methylphenyl)pyrazole-4-carboxylic acid Openeye Name: 3-tert-butyl-5-chloro-1-(o-tolyl)pyrazole-4-carboxylic acid CAS Name: 3-tert-butyl-5-chloro-1-(2-methylphenyl)-4-pyrazolecarboxylic acid IUPAC Name: 3-tert-butyl-5-chloro-1-(2-methylphenyl)pyrazole-4-carboxylic acid Traditional Name: 3-tert-butyl-5-chloro-1-(o-tolyl)pyrazole-4-carboxylic acid Formula: C15H17ClN2O2 MolecularWeight: 292.76068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17ClN2O2/c1-9-7-5-6-8-10(9)18-13(16)11(14(19)20)12(17-18)15(2,3)4/h5-8H,1-4H3,(H,19,20)