5-ethanoyl-1-(4-methylphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 5-ethanoyl-1-(4-methylphenyl)pyrazole-3-carboxylic acid Openeye Name: 5-acetyl-1-(p-tolyl)pyrazole-3-carboxylic acid CAS Name: 5-acetyl-1-(4-methylphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 5-acetyl-1-(4-methylphenyl)pyrazole-3-carboxylic acid Traditional Name: 5-acetyl-1-(p-tolyl)pyrazole-3-carboxylic acid Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N2O3/c1-8-3-5-10(6-4-8)15-12(9(2)16)7-11(14-15)13(17)18/h3-7H,1-2H3,(H,17,18)