2-[2-oxidanylidene-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]phthalazin-1-one

Systemtic Name: 2-[2-oxidanylidene-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]phthalazin-1-one Openeye Name: 2-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]phthalazin-1-one CAS Name: 2-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]-1-phthalazinone IUPAC Name: 2-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]phthalazin-1-one Traditional Name: 2-[2-keto-2-[4-[3-(trifluoromethyl)phenyl]piperazino]ethyl]phthalazin-1-one Formula: C21H19F3N4O2 MolecularWeight: 416.39637

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)CN3C(=O)C4=CC=CC=C4C=N3

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)CN3C(=O)C4=CC=CC=C4C=N3

InChI

InChI=1S/C21H19F3N4O2/c22-21(23,24)16-5-3-6-17(12-16)26-8-10-27(11-9-26)19(29)14-28-20(30)18-7-2-1-4-15(18)13-25-28/h1-7,12-13H,8-11,14H2