N-(2-oxidanylidene-2-piperazin-4-ium-1-yl-ethyl)benzenesulfonamide

Systemtic Name: N-(2-oxidanylidene-2-piperazin-4-ium-1-yl-ethyl)benzenesulfonamide Openeye Name: N-(2-oxo-2-piperazin-4-ium-1-yl-ethyl)benzenesulfonamide CAS Name: N-[2-oxo-2-(1-piperazin-4-iumyl)ethyl]benzenesulfonamide IUPAC Name: N-(2-oxo-2-piperazin-4-ium-1-ylethyl)benzenesulfonamide Traditional Name: N-(2-keto-2-piperazin-4-ium-1-yl-ethyl)benzenesulfonamide Formula: C12H18N3O3S+ MolecularWeight: 284.35462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O3S/c16-12(15-8-6-13-7-9-15)10-14-19(17,18)11-4-2-1-3-5-11/h1-5,13-14H,6-10H2/p+1