3-methyl-4-oxidanylidene-N-[2-[2,2,2-tris(fluoranyl)ethylcarbamoyl]phenyl]phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-[2-[2,2,2-tris(fluoranyl)ethylcarbamoyl]phenyl]phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-[2-(2,2,2-trifluoroethylcarbamoyl)phenyl]phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[2-[oxo-(2,2,2-trifluoroethylamino)methyl]phenyl]-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-[2-(2,2,2-trifluoroethylcarbamoyl)phenyl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[2-(2,2,2-trifluoroethylcarbamoyl)phenyl]phthalazine-1-carboxamide Formula: C19H15F3N4O3 MolecularWeight: 404.34261

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3C(=O)NCC(F)(F)F

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3C(=O)NCC(F)(F)F

InChI

InChI=1S/C19H15F3N4O3/c1-26-18(29)12-7-3-2-6-11(12)15(25-26)17(28)24-14-9-5-4-8-13(14)16(27)23-10-19(20,21)22/h2-9H,10H2,1H3,(H,23,27)(H,24,28)