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

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-N-[2,2,2-tris(fluoranyl)ethyl]phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-(2,2,2-trifluoroethyl)phthalazine-1-carboxamide CAS Name: 4-oxo-3-(phenylmethyl)-N-(2,2,2-trifluoroethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-(2,2,2-trifluoroethyl)phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-(2,2,2-trifluoroethyl)phthalazine-1-carboxamide Formula: C18H14F3N3O2 MolecularWeight: 361.31787

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(F)(F)F

InChI

InChI=1S/C18H14F3N3O2/c19-18(20,21)11-22-16(25)15-13-8-4-5-9-14(13)17(26)24(23-15)10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,22,25)