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

Systemtic Name: 3-methyl-1-(2-methylphenyl)pyrazole-4-carboxylic acid Openeye Name: 3-methyl-1-(o-tolyl)pyrazole-4-carboxylic acid CAS Name: 3-methyl-1-(2-methylphenyl)-4-pyrazolecarboxylic acid IUPAC Name: 3-methyl-1-(2-methylphenyl)pyrazole-4-carboxylic acid Traditional Name: 3-methyl-1-(o-tolyl)pyrazole-4-carboxylic acid Formula: C12H12N2O2 MolecularWeight: 216.23588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O2/c1-8-5-3-4-6-11(8)14-7-10(12(15)16)9(2)13-14/h3-7H,1-2H3,(H,15,16)