2-propan-2-yl-4-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]carbonyl-phthalazin-1-one

Systemtic Name: 2-propan-2-yl-4-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]carbonyl-phthalazin-1-one Openeye Name: 2-isopropyl-4-[4-[4-(trifluoromethyl)benzoyl]piperazine-1-carbonyl]phthalazin-1-one CAS Name: 4-[oxo-[4-[oxo-[4-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]methyl]-2-propan-2-yl-1-phthalazinone IUPAC Name: 2-propan-2-yl-4-[4-[4-(trifluoromethyl)benzoyl]piperazine-1-carbonyl]phthalazin-1-one Traditional Name: 2-isopropyl-4-[4-[4-(trifluoromethyl)benzoyl]piperazine-1-carbonyl]phthalazin-1-one Formula: C24H23F3N4O3 MolecularWeight: 472.45963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C24H23F3N4O3/c1-15(2)31-22(33)19-6-4-3-5-18(19)20(28-31)23(34)30-13-11-29(12-14-30)21(32)16-7-9-17(10-8-16)24(25,26)27/h3-10,15H,11-14H2,1-2H3