4-methyl-2-[3-(trifluoromethyl)phenyl]phthalazin-1-one

Systemtic Name: 4-methyl-2-[3-(trifluoromethyl)phenyl]phthalazin-1-one Openeye Name: 4-methyl-2-[3-(trifluoromethyl)phenyl]phthalazin-1-one CAS Name: 4-methyl-2-[3-(trifluoromethyl)phenyl]-1-phthalazinone IUPAC Name: 4-methyl-2-[3-(trifluoromethyl)phenyl]phthalazin-1-one Traditional Name: 4-methyl-2-[3-(trifluoromethyl)phenyl]phthalazin-1-one Formula: C16H11F3N2O MolecularWeight: 304.26655

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C16H11F3N2O/c1-10-13-7-2-3-8-14(13)15(22)21(20-10)12-6-4-5-11(9-12)16(17,18)19/h2-9H,1H3