ethyl 3-[2,4-bis(fluoranyl)phenyl]-4-bromanyl-1H-pyrazole-5-carboxylate

Systemtic Name: ethyl 3-[2,4-bis(fluoranyl)phenyl]-4-bromanyl-1H-pyrazole-5-carboxylate Openeye Name: ethyl 4-bromo-3-(2,4-difluorophenyl)-1H-pyrazole-5-carboxylate CAS Name: 4-bromo-3-(2,4-difluorophenyl)-1H-pyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-bromo-3-(2,4-difluorophenyl)-1H-pyrazole-5-carboxylate Traditional Name: 4-bromo-3-(2,4-difluorophenyl)-1H-pyrazole-5-carboxylic acid ethyl ester Formula: C12H9BrF2N2O2 MolecularWeight: 331.112866

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NN1)C2=C(C=C(C=C2)F)F)Br

Isomeric SMILES

CCOC(=O)C1=C(C(=NN1)C2=C(C=C(C=C2)F)F)Br

InChI

InChI=1S/C12H9BrF2N2O2/c1-2-19-12(18)11-9(13)10(16-17-11)7-4-3-6(14)5-8(7)15/h3-5H,2H2,1H3,(H,16,17)