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

Systemtic Name: 5-methyl-2-phenyl-4-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-1H-pyrazol-3-one Openeye Name: 5-methyl-2-phenyl-4-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-1H-pyrazol-3-one CAS Name: 5-methyl-2-phenyl-4-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-1H-pyrazol-3-one IUPAC Name: 5-methyl-2-phenyl-4-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-1H-pyrazol-3-one Traditional Name: 5-methyl-2-phenyl-4-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-3-pyrazolin-3-one Formula: C14H11F3N4O MolecularWeight: 308.25855

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C3=NNC(=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C3=NNC(=C3)C(F)(F)F

InChI

InChI=1S/C14H11F3N4O/c1-8-12(10-7-11(19-18-10)14(15,16)17)13(22)21(20-8)9-5-3-2-4-6-9/h2-7,20H,1H3,(H,18,19)