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

Systemtic Name: 4-oxidanylidene-N-[[3-(trifluoromethyl)phenyl]methyl]-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-[[3-(trifluoromethyl)phenyl]methyl]-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[[3-(trifluoromethyl)phenyl]methyl]-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-[[3-(trifluoromethyl)phenyl]methyl]-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[3-(trifluoromethyl)benzyl]-3H-phthalazine-1-carboxamide Formula: C17H12F3N3O2 MolecularWeight: 347.29129

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12F3N3O2/c18-17(19,20)11-5-3-4-10(8-11)9-21-16(25)14-12-6-1-2-7-13(12)15(24)23-22-14/h1-8H,9H2,(H,21,25)(H,23,24)