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

Systemtic Name: 2-propan-2-yl-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-phthalazin-1-one Openeye Name: 2-isopropyl-4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]phthalazin-1-one CAS Name: 4-[oxo-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]-2-propan-2-yl-1-phthalazinone IUPAC Name: 2-propan-2-yl-4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]phthalazin-1-one Traditional Name: 2-isopropyl-4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]phthalazin-1-one Formula: C23H23F3N4O2 MolecularWeight: 444.44953

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23F3N4O2/c1-15(2)30-21(31)19-9-4-3-8-18(19)20(27-30)22(32)29-12-10-28(11-13-29)17-7-5-6-16(14-17)23(24,25)26/h3-9,14-15H,10-13H2,1-2H3