2-[[3-(trifluoromethyl)phenyl]methyl]phthalazin-1-one

Systemtic Name: 2-[[3-(trifluoromethyl)phenyl]methyl]phthalazin-1-one Openeye Name: 2-[[3-(trifluoromethyl)phenyl]methyl]phthalazin-1-one CAS Name: 2-[[3-(trifluoromethyl)phenyl]methyl]-1-phthalazinone IUPAC Name: 2-[[3-(trifluoromethyl)phenyl]methyl]phthalazin-1-one Traditional Name: 2-[3-(trifluoromethyl)benzyl]phthalazin-1-one Formula: C16H11F3N2O MolecularWeight: 304.26655

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN(C2=O)CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=NN(C2=O)CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C16H11F3N2O/c17-16(18,19)13-6-3-4-11(8-13)10-21-15(22)14-7-2-1-5-12(14)9-20-21/h1-9H,10H2