2-(4-chlorophenyl)-4-[3-(trifluoromethyl)phenyl]phthalazin-1-one

Systemtic Name: 2-(4-chlorophenyl)-4-[3-(trifluoromethyl)phenyl]phthalazin-1-one Openeye Name: 2-(4-chlorophenyl)-4-[3-(trifluoromethyl)phenyl]phthalazin-1-one CAS Name: 2-(4-chlorophenyl)-4-[3-(trifluoromethyl)phenyl]-1-phthalazinone IUPAC Name: 2-(4-chlorophenyl)-4-[3-(trifluoromethyl)phenyl]phthalazin-1-one Traditional Name: 2-(4-chlorophenyl)-4-[3-(trifluoromethyl)phenyl]phthalazin-1-one Formula: C21H12ClF3N2O MolecularWeight: 400.78099

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H12ClF3N2O/c22-15-8-10-16(11-9-15)27-20(28)18-7-2-1-6-17(18)19(26-27)13-4-3-5-14(12-13)21(23,24)25/h1-12H