1-(2,5-dimethylphenyl)pyrazole-4-carboxylic acid

Systemtic Name: 1-(2,5-dimethylphenyl)pyrazole-4-carboxylic acid Openeye Name: 1-(2,5-dimethylphenyl)pyrazole-4-carboxylic acid CAS Name: 1-(2,5-dimethylphenyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-(2,5-dimethylphenyl)pyrazole-4-carboxylic acid Traditional Name: 1-(2,5-dimethylphenyl)pyrazole-4-carboxylic acid Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C=C(C=N2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C=C(C=N2)C(=O)O

InChI

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