4-chloranyl-N-(2-methyl-1-piperazin-4-ium-1-yl-propan-2-yl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2-methyl-1-piperazin-4-ium-1-yl-propan-2-yl)benzenesulfonamide Openeye Name: 4-chloro-N-(1,1-dimethyl-2-piperazin-4-ium-1-yl-ethyl)benzenesulfonamide CAS Name: 4-chloro-N-[2-methyl-1-(1-piperazin-4-iumyl)propan-2-yl]benzenesulfonamide IUPAC Name: 4-chloro-N-(2-methyl-1-piperazin-4-ium-1-ylpropan-2-yl)benzenesulfonamide Traditional Name: 4-chloro-N-(1,1-dimethyl-2-piperazin-4-ium-1-yl-ethyl)benzenesulfonamide Formula: C14H23ClN3O2S+ MolecularWeight: 332.86932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1CC[NH2+]CC1)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(CN1CC[NH2+]CC1)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H22ClN3O2S/c1-14(2,11-18-9-7-16-8-10-18)17-21(19,20)13-5-3-12(15)4-6-13/h3-6,16-17H,7-11H2,1-2H3/p+1