N-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[4-fluoro-2-(trifluoromethyl)benzyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C17H11F4N3O2 MolecularWeight: 365.281753

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NCC3=C(C=C(C=C3)F)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NCC3=C(C=C(C=C3)F)C(F)(F)F

InChI

InChI=1S/C17H11F4N3O2/c18-10-6-5-9(13(7-10)17(19,20)21)8-22-16(26)14-11-3-1-2-4-12(11)15(25)24-23-14/h1-7H,8H2,(H,22,26)(H,24,25)