2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-fluorophenyl)ethanamide

Systemtic Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-fluorophenyl)ethanamide Openeye Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-fluorophenyl)acetamide CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(2-fluorophenyl)acetamide IUPAC Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-fluorophenyl)acetamide Traditional Name: 2-(4-brosylpiperazin-1-ium-1-yl)-N-(2-fluorophenyl)acetamide Formula: C18H20BrFN3O3S+ MolecularWeight: 457.337103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2F)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2F)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H19BrFN3O3S/c19-14-5-7-15(8-6-14)27(25,26)23-11-9-22(10-12-23)13-18(24)21-17-4-2-1-3-16(17)20/h1-8H,9-13H2,(H,21,24)/p+1