ethyl 1-(4-bromophenyl)-5-oxidanylidene-4H-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(4-bromophenyl)-5-oxidanylidene-4H-pyrazole-4-carboxylate Openeye Name: ethyl 1-(4-bromophenyl)-5-oxo-4H-pyrazole-4-carboxylate CAS Name: 1-(4-bromophenyl)-5-oxo-4H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-bromophenyl)-5-oxo-4H-pyrazole-4-carboxylate Traditional Name: 1-(4-bromophenyl)-5-keto-2-pyrazoline-4-carboxylic acid ethyl ester Formula: C12H11BrN2O3 MolecularWeight: 311.13134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C=NN(C1=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)C1C=NN(C1=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C12H11BrN2O3/c1-2-18-12(17)10-7-14-15(11(10)16)9-5-3-8(13)4-6-9/h3-7,10H,2H2,1H3