[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 3,5-dimethyl-1-phenyl-4-pyrazolecarboxylic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 3,5-dimethyl-1-phenylpyrazole-4-carboxylate Traditional Name: 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C22H21FN2O3 MolecularWeight: 380.412143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)OCCCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)OCCCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H21FN2O3/c1-15-21(16(2)25(24-15)19-7-4-3-5-8-19)22(27)28-14-6-9-20(26)17-10-12-18(23)13-11-17/h3-5,7-8,10-13H,6,9,14H2,1-2H3