N-methyl-4-oxidanylidene-3-[[3-(trifluoromethyl)phenyl]methyl]phthalazine-1-carboxamide

Systemtic Name: N-methyl-4-oxidanylidene-3-[[3-(trifluoromethyl)phenyl]methyl]phthalazine-1-carboxamide Openeye Name: N-methyl-4-oxo-3-[[3-(trifluoromethyl)phenyl]methyl]phthalazine-1-carboxamide CAS Name: N-methyl-4-oxo-3-[[3-(trifluoromethyl)phenyl]methyl]-1-phthalazinecarboxamide IUPAC Name: N-methyl-4-oxo-3-[[3-(trifluoromethyl)phenyl]methyl]phthalazine-1-carboxamide Traditional Name: 4-keto-N-methyl-3-[3-(trifluoromethyl)benzyl]phthalazine-1-carboxamide Formula: C18H14F3N3O2 MolecularWeight: 361.31787

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O2/c1-22-16(25)15-13-7-2-3-8-14(13)17(26)24(23-15)10-11-5-4-6-12(9-11)18(19,20)21/h2-9H,10H2,1H3,(H,22,25)