4-(4-ethanoyl-5-methyl-pyrazol-1-yl)benzoate

Systemtic Name: 4-(4-ethanoyl-5-methyl-pyrazol-1-yl)benzoate Openeye Name: 4-(4-acetyl-5-methyl-pyrazol-1-yl)benzoate CAS Name: 4-(4-acetyl-5-methyl-1-pyrazolyl)benzoate IUPAC Name: 4-(4-acetyl-5-methylpyrazol-1-yl)benzoate Traditional Name: 4-(4-acetyl-5-methyl-pyrazol-1-yl)benzoate Formula: C13H11N2O3- MolecularWeight: 243.23804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)C(=O)[O-])C(=O)C

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)C(=O)[O-])C(=O)C

InChI

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