3-cyano-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]benzenesulfonamide

Systemtic Name: 3-cyano-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]benzenesulfonamide Openeye Name: 3-cyano-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]benzenesulfonamide CAS Name: 3-cyano-N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]benzenesulfonamide IUPAC Name: 3-cyano-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]benzenesulfonamide Traditional Name: 3-cyano-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]benzenesulfonamide Formula: C16H24N3O2S+ MolecularWeight: 322.44566

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNS(=O)(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC1CC[NH+](CC1)CCCNS(=O)(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C16H23N3O2S/c1-14-6-10-19(11-7-14)9-3-8-18-22(20,21)16-5-2-4-15(12-16)13-17/h2,4-5,12,14,18H,3,6-11H2,1H3/p+1