1-(2-methylpropyl)-3-(2,4,6-trimethylphenyl)pyrazole-4-carboxylic acid

Systemtic Name: 1-(2-methylpropyl)-3-(2,4,6-trimethylphenyl)pyrazole-4-carboxylic acid Openeye Name: 1-isobutyl-3-(2,4,6-trimethylphenyl)pyrazole-4-carboxylic acid CAS Name: 1-(2-methylpropyl)-3-(2,4,6-trimethylphenyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-(2-methylpropyl)-3-(2,4,6-trimethylphenyl)pyrazole-4-carboxylic acid Traditional Name: 1-isobutyl-3-mesityl-pyrazole-4-carboxylic acid Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O2/c1-10(2)8-19-9-14(17(20)21)16(18-19)15-12(4)6-11(3)7-13(15)5/h6-7,9-10H,8H2,1-5H3,(H,20,21)