ethyl 1-(2-chloranyl-4-fluoranyl-phenyl)-4-ethanoyl-5-methyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(2-chloranyl-4-fluoranyl-phenyl)-4-ethanoyl-5-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 4-acetyl-1-(2-chloro-4-fluoro-phenyl)-5-methyl-pyrazole-3-carboxylate CAS Name: 4-acetyl-1-(2-chloro-4-fluorophenyl)-5-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-1-(2-chloro-4-fluorophenyl)-5-methylpyrazole-3-carboxylate Traditional Name: 4-acetyl-1-(2-chloro-4-fluoro-phenyl)-5-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C15H14ClFN2O3 MolecularWeight: 324.734663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1C(=O)C)C)C2=C(C=C(C=C2)F)Cl

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1C(=O)C)C)C2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C15H14ClFN2O3/c1-4-22-15(21)14-13(9(3)20)8(2)19(18-14)12-6-5-10(17)7-11(12)16/h5-7H,4H2,1-3H3