[(1S)-1-(4-fluorophenyl)-2-(2-oxidanylidenepyrimidin-1-yl)ethyl]azanium

Systemtic Name: [(1S)-1-(4-fluorophenyl)-2-(2-oxidanylidenepyrimidin-1-yl)ethyl]azanium Openeye Name: [(1S)-1-(4-fluorophenyl)-2-(2-oxopyrimidin-1-yl)ethyl]ammonium CAS Name: [(1S)-1-(4-fluorophenyl)-2-(2-oxo-1-pyrimidinyl)ethyl]ammonium IUPAC Name: [(1S)-1-(4-fluorophenyl)-2-(2-oxopyrimidin-1-yl)ethyl]azanium Traditional Name: [(1S)-1-(4-fluorophenyl)-2-(2-ketopyrimidin-1-yl)ethyl]ammonium Formula: C12H13FN3O+ MolecularWeight: 234.249523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1)CC(C2=CC=C(C=C2)F)[NH3+]

Isomeric SMILES

C1=CN(C(=O)N=C1)C[C@H](C2=CC=C(C=C2)F)[NH3+]

InChI

InChI=1S/C12H12FN3O/c13-10-4-2-9(3-5-10)11(14)8-16-7-1-6-15-12(16)17/h1-7,11H,8,14H2/p+1/t11-/m1/s1