2-phenyl-4-[[6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]carbonyl]phthalazin-1-one

Systemtic Name: 2-phenyl-4-[[6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]carbonyl]phthalazin-1-one Openeye Name: 2-phenyl-4-[6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carbonyl]phthalazin-1-one CAS Name: 4-[oxo-[6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-2-phenyl-1-phthalazinone IUPAC Name: 2-phenyl-4-[6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carbonyl]phthalazin-1-one Traditional Name: 2-phenyl-4-[6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carbonyl]phthalazin-1-one Formula: C25H18F3N3O2 MolecularWeight: 449.42453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C(F)(F)F)N(C1)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1CC2=C(C=CC(=C2)C(F)(F)F)N(C1)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H18F3N3O2/c26-25(27,28)17-12-13-21-16(15-17)7-6-14-30(21)24(33)22-19-10-4-5-11-20(19)23(32)31(29-22)18-8-2-1-3-9-18/h1-5,8-13,15H,6-7,14H2