N-(4-piperazin-4-ium-1-ylphenyl)benzenesulfonamide

Systemtic Name: N-(4-piperazin-4-ium-1-ylphenyl)benzenesulfonamide Openeye Name: N-(4-piperazin-4-ium-1-ylphenyl)benzenesulfonamide CAS Name: N-[4-(1-piperazin-4-iumyl)phenyl]benzenesulfonamide IUPAC Name: N-(4-piperazin-4-ium-1-ylphenyl)benzenesulfonamide Traditional Name: N-(4-piperazin-4-ium-1-ylphenyl)benzenesulfonamide Formula: C16H20N3O2S+ MolecularWeight: 318.4139

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H19N3O2S/c20-22(21,16-4-2-1-3-5-16)18-14-6-8-15(9-7-14)19-12-10-17-11-13-19/h1-9,17-18H,10-13H2/p+1