ethyl 1-(4-bromophenyl)-5-ethanoyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(4-bromophenyl)-5-ethanoyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-acetyl-1-(4-bromophenyl)pyrazole-3-carboxylate CAS Name: 5-acetyl-1-(4-bromophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-1-(4-bromophenyl)pyrazole-3-carboxylate Traditional Name: 5-acetyl-1-(4-bromophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C14H13BrN2O3 MolecularWeight: 337.16862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrN2O3/c1-3-20-14(19)12-8-13(9(2)18)17(16-12)11-6-4-10(15)5-7-11/h4-8H,3H2,1-2H3