N-[1-(4-ethanoylpiperazin-1-ium-1-yl)-2-methyl-propan-2-yl]benzenesulfonamide

Systemtic Name: N-[1-(4-ethanoylpiperazin-1-ium-1-yl)-2-methyl-propan-2-yl]benzenesulfonamide Openeye Name: N-[2-(4-acetylpiperazin-1-ium-1-yl)-1,1-dimethyl-ethyl]benzenesulfonamide CAS Name: N-[1-(4-acetyl-1-piperazin-1-iumyl)-2-methylpropan-2-yl]benzenesulfonamide IUPAC Name: N-[1-(4-acetylpiperazin-1-ium-1-yl)-2-methylpropan-2-yl]benzenesulfonamide Traditional Name: N-[2-(4-acetylpiperazin-1-ium-1-yl)-1,1-dimethyl-ethyl]benzenesulfonamide Formula: C16H26N3O3S+ MolecularWeight: 340.46094

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(C)(C)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC(C)(C)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H25N3O3S/c1-14(20)19-11-9-18(10-12-19)13-16(2,3)17-23(21,22)15-7-5-4-6-8-15/h4-8,17H,9-13H2,1-3H3/p+1