4-chloranyl-N-[1-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-2-methyl-propan-2-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[1-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-2-methyl-propan-2-yl]benzenesulfonamide Openeye Name: 4-chloro-N-[2-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-1,1-dimethyl-ethyl]benzenesulfonamide CAS Name: 4-chloro-N-[1-[4-(2-hydroxyethyl)-1-piperazine-1,4-diiumyl]-2-methylpropan-2-yl]benzenesulfonamide IUPAC Name: 4-chloro-N-[1-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-2-methylpropan-2-yl]benzenesulfonamide Traditional Name: 4-chloro-N-[2-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-1,1-dimethyl-ethyl]benzenesulfonamide Formula: C16H28ClN3O3S+2 MolecularWeight: 377.92982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH+]1CC[NH+](CC1)CCO)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C[NH+]1CC[NH+](CC1)CCO)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H26ClN3O3S/c1-16(2,13-20-9-7-19(8-10-20)11-12-21)18-24(22,23)15-5-3-14(17)4-6-15/h3-6,18,21H,7-13H2,1-2H3/p+2