methyl 4-(4-fluorophenyl)carbonyl-5-oxidanylidene-1,2-dihydropyrazole-3-carboxylate

Systemtic Name: methyl 4-(4-fluorophenyl)carbonyl-5-oxidanylidene-1,2-dihydropyrazole-3-carboxylate Openeye Name: methyl 4-(4-fluorobenzoyl)-5-oxo-1,2-dihydropyrazole-3-carboxylate CAS Name: 4-[(4-fluorophenyl)-oxomethyl]-5-oxo-1,2-dihydropyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-fluorobenzoyl)-5-oxo-1,2-dihydropyrazole-3-carboxylate Traditional Name: 4-(4-fluorobenzoyl)-5-keto-3-pyrazoline-3-carboxylic acid methyl ester Formula: C12H9FN2O4 MolecularWeight: 264.209263

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=O)NN1)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)C1=C(C(=O)NN1)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C12H9FN2O4/c1-19-12(18)9-8(11(17)15-14-9)10(16)6-2-4-7(13)5-3-6/h2-5H,1H3,(H2,14,15,17)