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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O2/c1-10(2)9-13-15(16(19)20)12(4)18(17-13)14-8-6-5-7-11(14)3/h5-8,10H,9H2,1-4H3,(H,19,20)