3-chloranyl-N-(2-piperazin-4-ium-1-ylethyl)benzenesulfonamide

Systemtic Name: 3-chloranyl-N-(2-piperazin-4-ium-1-ylethyl)benzenesulfonamide Openeye Name: 3-chloro-N-(2-piperazin-4-ium-1-ylethyl)benzenesulfonamide CAS Name: 3-chloro-N-[2-(1-piperazin-4-iumyl)ethyl]benzenesulfonamide IUPAC Name: 3-chloro-N-(2-piperazin-4-ium-1-ylethyl)benzenesulfonamide Traditional Name: 3-chloro-N-(2-piperazin-4-ium-1-ylethyl)benzenesulfonamide Formula: C12H19ClN3O2S+ MolecularWeight: 304.81616

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CCNS(=O)(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

C1CN(CC[NH2+]1)CCNS(=O)(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C12H18ClN3O2S/c13-11-2-1-3-12(10-11)19(17,18)15-6-9-16-7-4-14-5-8-16/h1-3,10,14-15H,4-9H2/p+1