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

Systemtic Name: ethyl 1-[4-cyano-2,5-bis(fluoranyl)phenyl]-3,5-dimethyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-(4-cyano-2,5-difluoro-phenyl)-3,5-dimethyl-pyrazole-4-carboxylate CAS Name: 1-(4-cyano-2,5-difluorophenyl)-3,5-dimethyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-cyano-2,5-difluorophenyl)-3,5-dimethylpyrazole-4-carboxylate Traditional Name: 1-(4-cyano-2,5-difluoro-phenyl)-3,5-dimethyl-pyrazole-4-carboxylic acid ethyl ester Formula: C15H13F2N3O2 MolecularWeight: 305.279426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1C)C2=C(C=C(C(=C2)F)C#N)F)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1C)C2=C(C=C(C(=C2)F)C#N)F)C

InChI

InChI=1S/C15H13F2N3O2/c1-4-22-15(21)14-8(2)19-20(9(14)3)13-6-11(16)10(7-18)5-12(13)17/h5-6H,4H2,1-3H3