5-phenyl-2-[4-(trifluoromethyl)phenyl]-1H-pyrazol-3-one

Systemtic Name: 5-phenyl-2-[4-(trifluoromethyl)phenyl]-1H-pyrazol-3-one Openeye Name: 5-phenyl-2-[4-(trifluoromethyl)phenyl]-1H-pyrazol-3-one CAS Name: 5-phenyl-2-[4-(trifluoromethyl)phenyl]-1H-pyrazol-3-one IUPAC Name: 5-phenyl-2-[4-(trifluoromethyl)phenyl]-1H-pyrazol-3-one Traditional Name: 5-phenyl-2-[4-(trifluoromethyl)phenyl]-3-pyrazolin-3-one Formula: C16H11F3N2O MolecularWeight: 304.26655

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)N(N2)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)N(N2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H11F3N2O/c17-16(18,19)12-6-8-13(9-7-12)21-15(22)10-14(20-21)11-4-2-1-3-5-11/h1-10,20H