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

Systemtic Name: 1-(4-fluorophenyl)-4-(phenylsulfonyl)piperazin-1-ium Openeye Name: 1-(benzenesulfonyl)-4-(4-fluorophenyl)piperazin-4-ium CAS Name: 1-(benzenesulfonyl)-4-(4-fluorophenyl)piperazin-4-ium IUPAC Name: 1-(benzenesulfonyl)-4-(4-fluorophenyl)piperazin-4-ium Traditional Name: 1-besyl-4-(4-fluorophenyl)piperazin-4-ium Formula: C16H18FN2O2S+ MolecularWeight: 321.389723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17FN2O2S/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/p+1