N-(4-fluorophenyl)-2-[(2R)-3-oxidanylidenepiperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[(2R)-3-oxidanylidenepiperazin-1-ium-2-yl]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[(2R)-3-oxopiperazin-1-ium-2-yl]acetamide CAS Name: N-(4-fluorophenyl)-2-[(2R)-3-oxo-2-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[(2R)-3-oxopiperazin-1-ium-2-yl]acetamide Traditional Name: N-(4-fluorophenyl)-2-[(2R)-3-ketopiperazin-1-ium-2-yl]acetamide Formula: C12H15FN3O2+ MolecularWeight: 252.264803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C([NH2+]1)CC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

C1CNC(=O)[C@H]([NH2+]1)CC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C12H14FN3O2/c13-8-1-3-9(4-2-8)16-11(17)7-10-12(18)15-6-5-14-10/h1-4,10,14H,5-7H2,(H,15,18)(H,16,17)/p+1/t10-/m1/s1