4-[3-(trifluoromethyl)piperidin-1-yl]carbonyl-2H-phthalazin-1-one

Systemtic Name: 4-[3-(trifluoromethyl)piperidin-1-yl]carbonyl-2H-phthalazin-1-one Openeye Name: 4-[3-(trifluoromethyl)piperidine-1-carbonyl]-2H-phthalazin-1-one CAS Name: 4-[oxo-[3-(trifluoromethyl)-1-piperidinyl]methyl]-2H-phthalazin-1-one IUPAC Name: 4-[3-(trifluoromethyl)piperidine-1-carbonyl]-2H-phthalazin-1-one Traditional Name: 4-[3-(trifluoromethyl)piperidine-1-carbonyl]-2H-phthalazin-1-one Formula: C15H14F3N3O2 MolecularWeight: 325.28577

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=NNC(=O)C3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=NNC(=O)C3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C15H14F3N3O2/c16-15(17,18)9-4-3-7-21(8-9)14(23)12-10-5-1-2-6-11(10)13(22)20-19-12/h1-2,5-6,9H,3-4,7-8H2,(H,20,22)