N-[1-(1-oxidanylidenepiperidin-1-ium-2-yl)pentan-2-yl]benzenesulfonamide

Systemtic Name: N-[1-(1-oxidanylidenepiperidin-1-ium-2-yl)pentan-2-yl]benzenesulfonamide Openeye Name: N-[1-[(1-oxopiperidin-1-ium-2-yl)methyl]butyl]benzenesulfonamide CAS Name: N-[1-(1-oxo-2-piperidin-1-iumyl)pentan-2-yl]benzenesulfonamide IUPAC Name: N-[1-(1-oxopiperidin-1-ium-2-yl)pentan-2-yl]benzenesulfonamide Traditional Name: N-[1-[(1-ketopiperidin-1-ium-2-yl)methyl]butyl]benzenesulfonamide Formula: C16H25N2O3S+ MolecularWeight: 325.4463

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1CCCC[N+]1=O)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCC(CC1CCCC[N+]1=O)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H25N2O3S/c1-2-8-14(13-15-9-6-7-12-18(15)19)17-22(20,21)16-10-4-3-5-11-16/h3-5,10-11,14-15,17H,2,6-9,12-13H2,1H3/q+1