4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-2H-phthalazin-1-one

Systemtic Name: 4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-2H-phthalazin-1-one Openeye Name: 4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]-2H-phthalazin-1-one CAS Name: 4-[oxo-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]-2H-phthalazin-1-one IUPAC Name: 4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]-2H-phthalazin-1-one Traditional Name: 4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]-2H-phthalazin-1-one Formula: C20H17F3N4O2 MolecularWeight: 402.36979

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H17F3N4O2/c21-20(22,23)13-4-3-5-14(12-13)26-8-10-27(11-9-26)19(29)17-15-6-1-2-7-16(15)18(28)25-24-17/h1-7,12H,8-11H2,(H,25,28)