ethyl 1-(4-methylphenyl)-4,5-bis(oxidanylidene)pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(4-methylphenyl)-4,5-bis(oxidanylidene)pyrazole-3-carboxylate Openeye Name: ethyl 4,5-dioxo-1-(p-tolyl)pyrazole-3-carboxylate CAS Name: 1-(4-methylphenyl)-4,5-dioxo-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methylphenyl)-4,5-dioxopyrazole-3-carboxylate Traditional Name: 4,5-diketo-1-(p-tolyl)-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C1=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C1=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C13H12N2O4/c1-3-19-13(18)10-11(16)12(17)15(14-10)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3