N-methyl-N-(2-piperazin-4-ium-1-ylethyl)benzenesulfonamide

Systemtic Name: N-methyl-N-(2-piperazin-4-ium-1-ylethyl)benzenesulfonamide Openeye Name: N-methyl-N-(2-piperazin-4-ium-1-ylethyl)benzenesulfonamide CAS Name: N-methyl-N-[2-(1-piperazin-4-iumyl)ethyl]benzenesulfonamide IUPAC Name: N-methyl-N-(2-piperazin-4-ium-1-ylethyl)benzenesulfonamide Traditional Name: N-methyl-N-(2-piperazin-4-ium-1-ylethyl)benzenesulfonamide Formula: C13H22N3O2S+ MolecularWeight: 284.39768

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCN1CC[NH2+]CC1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CN(CCN1CC[NH2+]CC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H21N3O2S/c1-15(11-12-16-9-7-14-8-10-16)19(17,18)13-5-3-2-4-6-13/h2-6,14H,7-12H2,1H3/p+1