ethyl 3-(4-chlorophenyl)-5-oxidanylidene-1,2-dihydropyrazole-4-carboxylate

Systemtic Name: ethyl 3-(4-chlorophenyl)-5-oxidanylidene-1,2-dihydropyrazole-4-carboxylate Openeye Name: ethyl 3-(4-chlorophenyl)-5-oxo-1,2-dihydropyrazole-4-carboxylate CAS Name: 3-(4-chlorophenyl)-5-oxo-1,2-dihydropyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-chlorophenyl)-5-oxo-1,2-dihydropyrazole-4-carboxylate Traditional Name: 3-(4-chlorophenyl)-5-keto-3-pyrazoline-4-carboxylic acid ethyl ester Formula: C12H11ClN2O3 MolecularWeight: 266.68034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NNC1=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=C(NNC1=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H11ClN2O3/c1-2-18-12(17)9-10(14-15-11(9)16)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H2,14,15,16)