3-[4-(4-methylphenyl)-1-oxidanylidene-phthalazin-2-yl]-N-[3-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 3-[4-(4-methylphenyl)-1-oxidanylidene-phthalazin-2-yl]-N-[3-(trifluoromethyl)phenyl]propanamide Openeye Name: 3-[1-oxo-4-(p-tolyl)phthalazin-2-yl]-N-[3-(trifluoromethyl)phenyl]propanamide CAS Name: 3-[4-(4-methylphenyl)-1-oxo-2-phthalazinyl]-N-[3-(trifluoromethyl)phenyl]propanamide IUPAC Name: 3-[4-(4-methylphenyl)-1-oxophthalazin-2-yl]-N-[3-(trifluoromethyl)phenyl]propanamide Traditional Name: 3-[1-keto-4-(p-tolyl)phthalazin-2-yl]-N-[3-(trifluoromethyl)phenyl]propionamide Formula: C25H20F3N3O2 MolecularWeight: 451.44041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCC(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCC(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C25H20F3N3O2/c1-16-9-11-17(12-10-16)23-20-7-2-3-8-21(20)24(33)31(30-23)14-13-22(32)29-19-6-4-5-18(15-19)25(26,27)28/h2-12,15H,13-14H2,1H3,(H,29,32)