(1-phenylpyrazol-4-yl)methyl 4-(4-fluorophenyl)-4-oxidanylidene-butanoate

Systemtic Name: (1-phenylpyrazol-4-yl)methyl 4-(4-fluorophenyl)-4-oxidanylidene-butanoate Openeye Name: (1-phenylpyrazol-4-yl)methyl 4-(4-fluorophenyl)-4-oxo-butanoate CAS Name: 4-(4-fluorophenyl)-4-oxobutanoic acid (1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (1-phenylpyrazol-4-yl)methyl 4-(4-fluorophenyl)-4-oxobutanoate Traditional Name: 4-(4-fluorophenyl)-4-keto-butyric acid (1-phenylpyrazol-4-yl)methyl ester Formula: C20H17FN2O3 MolecularWeight: 352.358983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)COC(=O)CCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)COC(=O)CCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H17FN2O3/c21-17-8-6-16(7-9-17)19(24)10-11-20(25)26-14-15-12-22-23(13-15)18-4-2-1-3-5-18/h1-9,12-13H,10-11,14H2