3-methyl-4-piperazin-4-ium-1-yl-benzenesulfonamide

Systemtic Name: 3-methyl-4-piperazin-4-ium-1-yl-benzenesulfonamide Openeye Name: 3-methyl-4-piperazin-4-ium-1-yl-benzenesulfonamide CAS Name: 3-methyl-4-(1-piperazin-4-iumyl)benzenesulfonamide IUPAC Name: 3-methyl-4-piperazin-4-ium-1-ylbenzenesulfonamide Traditional Name: 3-methyl-4-piperazin-4-ium-1-yl-benzenesulfonamide Formula: C11H18N3O2S+ MolecularWeight: 256.34452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N)N2CC[NH2+]CC2

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N)N2CC[NH2+]CC2

InChI

InChI=1S/C11H17N3O2S/c1-9-8-10(17(12,15)16)2-3-11(9)14-6-4-13-5-7-14/h2-3,8,13H,4-7H2,1H3,(H2,12,15,16)/p+1