3-butyl-4-oxidanylidene-N-[2,2,2-tris(fluoranyl)ethyl]phthalazine-1-carboxamide

Systemtic Name: 3-butyl-4-oxidanylidene-N-[2,2,2-tris(fluoranyl)ethyl]phthalazine-1-carboxamide Openeye Name: 3-butyl-4-oxo-N-(2,2,2-trifluoroethyl)phthalazine-1-carboxamide CAS Name: 3-butyl-4-oxo-N-(2,2,2-trifluoroethyl)-1-phthalazinecarboxamide IUPAC Name: 3-butyl-4-oxo-N-(2,2,2-trifluoroethyl)phthalazine-1-carboxamide Traditional Name: 3-butyl-4-keto-N-(2,2,2-trifluoroethyl)phthalazine-1-carboxamide Formula: C15H16F3N3O2 MolecularWeight: 327.30165

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(F)(F)F

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(F)(F)F

InChI

InChI=1S/C15H16F3N3O2/c1-2-3-8-21-14(23)11-7-5-4-6-10(11)12(20-21)13(22)19-9-15(16,17)18/h4-7H,2-3,8-9H2,1H3,(H,19,22)