[(1S)-1-(3-fluorophenyl)-2-[(4-oxidanylidene-3-phenyl-phthalazin-1-yl)carbonylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(3-fluorophenyl)-2-[(4-oxidanylidene-3-phenyl-phthalazin-1-yl)carbonylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(3-fluorophenyl)-2-[(4-oxo-3-phenyl-phthalazine-1-carbonyl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(3-fluorophenyl)-2-[[oxo-(4-oxo-3-phenyl-1-phthalazinyl)methyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(3-fluorophenyl)-2-[(4-oxo-3-phenylphthalazine-1-carbonyl)amino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(3-fluorophenyl)-2-[(4-keto-3-phenyl-phthalazine-1-carbonyl)amino]ethyl]-dimethyl-ammonium Formula: C25H24FN4O2+ MolecularWeight: 431.482063

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3)C4=CC(=CC=C4)F

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3)C4=CC(=CC=C4)F

InChI

InChI=1S/C25H23FN4O2/c1-29(2)22(17-9-8-10-18(26)15-17)16-27-24(31)23-20-13-6-7-14-21(20)25(32)30(28-23)19-11-4-3-5-12-19/h3-15,22H,16H2,1-2H3,(H,27,31)/p+1/t22-/m1/s1