1-(4-fluorophenyl)-4-(phenylsulfonyl)piperazin-1-ium chloride

Systemtic Name: 1-(4-fluorophenyl)-4-(phenylsulfonyl)piperazin-1-ium chloride Openeye Name: 1-(benzenesulfonyl)-4-(4-fluorophenyl)piperazin-4-ium chloride CAS Name: 1-(benzenesulfonyl)-4-(4-fluorophenyl)piperazin-4-ium chloride IUPAC Name: 1-(benzenesulfonyl)-4-(4-fluorophenyl)piperazin-4-ium chloride Traditional Name: 1-besyl-4-(4-fluorophenyl)piperazin-4-ium chloride Formula: C16H18ClFN2O2S MolecularWeight: 356.842723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1CN(CC[NH+]1C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C16H17FN2O2S.ClH/c17-14-6-8-15(9-7-14)18-10-12-19(13-11-18)22(20,21)16-4-2-1-3-5-16;/h1-9H,10-13H2;1H