methyl 1-(2-methylphenyl)carbonylpyrazole-3-carboxylate

Systemtic Name: methyl 1-(2-methylphenyl)carbonylpyrazole-3-carboxylate Openeye Name: methyl 1-(2-methylbenzoyl)pyrazole-3-carboxylate CAS Name: 1-[(2-methylphenyl)-oxomethyl]-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-methylbenzoyl)pyrazole-3-carboxylate Traditional Name: 1-o-toluoylpyrazole-3-carboxylic acid methyl ester Formula: C13H12N2O3 MolecularWeight: 244.24598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2C=CC(=N2)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2C=CC(=N2)C(=O)OC

InChI

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