ethyl 4-oxidanylidene-5-(phenylcarbonyl)-1,5-dihydropyrazole-3-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-5-(phenylcarbonyl)-1,5-dihydropyrazole-3-carboxylate Openeye Name: ethyl 5-benzoyl-4-oxo-1,5-dihydropyrazole-3-carboxylate CAS Name: 5-benzoyl-4-oxo-1,5-dihydropyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-benzoyl-4-oxo-1,5-dihydropyrazole-3-carboxylate Traditional Name: 5-benzoyl-4-keto-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=NNC(C1=O)C(=O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C13H12N2O4/c1-2-19-13(18)10-12(17)9(14-15-10)11(16)8-6-4-3-5-7-8/h3-7,9,14H,2H2,1H3