[(1S)-1-(3-fluorophenyl)-2-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(3-fluorophenyl)-2-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(3-fluorophenyl)-2-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(3-fluorophenyl)-2-[[oxo-(2-pyridin-4-yl-4-quinolinyl)methyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(3-fluorophenyl)-2-[(2-pyridin-4-ylquinoline-4-carbonyl)amino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(3-fluorophenyl)-2-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]ethyl]-dimethyl-ammonium Formula: C25H24FN4O+ MolecularWeight: 415.482663

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=NC=C3)C4=CC(=CC=C4)F

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=NC=C3)C4=CC(=CC=C4)F

InChI

InChI=1S/C25H23FN4O/c1-30(2)24(18-6-5-7-19(26)14-18)16-28-25(31)21-15-23(17-10-12-27-13-11-17)29-22-9-4-3-8-20(21)22/h3-15,24H,16H2,1-2H3,(H,28,31)/p+1/t24-/m1/s1