(3-fluoranyl-4-methoxy-phenyl) 2-phenethylpyrazole-3-carboxylate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl) 2-phenethylpyrazole-3-carboxylate Openeye Name: (3-fluoro-4-methoxy-phenyl) 2-phenethylpyrazole-3-carboxylate CAS Name: 2-phenethyl-3-pyrazolecarboxylic acid (3-fluoro-4-methoxyphenyl) ester IUPAC Name: (3-fluoro-4-methoxyphenyl) 2-phenethylpyrazole-3-carboxylate Traditional Name: 2-phenethylpyrazole-3-carboxylic acid (3-fluoro-4-methoxy-phenyl) ester Formula: C19H17FN2O3 MolecularWeight: 340.348283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)OC(=O)C2=CC=NN2CCC3=CC=CC=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)OC(=O)C2=CC=NN2CCC3=CC=CC=C3)F

InChI

InChI=1S/C19H17FN2O3/c1-24-18-8-7-15(13-16(18)20)25-19(23)17-9-11-21-22(17)12-10-14-5-3-2-4-6-14/h2-9,11,13H,10,12H2,1H3