1-(3-methylphenyl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]methanesulfonamide

Systemtic Name: 1-(3-methylphenyl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]methanesulfonamide Openeye Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-(m-tolyl)methanesulfonamide CAS Name: 1-(3-methylphenyl)-N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]methanesulfonamide IUPAC Name: 1-(3-methylphenyl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]methanesulfonamide Traditional Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-(m-tolyl)methanesulfonamide Formula: C17H29N2O2S+ MolecularWeight: 325.48936

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNS(=O)(=O)CC2=CC=CC(=C2)C

Isomeric SMILES

CC1CC[NH+](CC1)CCCNS(=O)(=O)CC2=CC=CC(=C2)C

InChI

InChI=1S/C17H28N2O2S/c1-15-7-11-19(12-8-15)10-4-9-18-22(20,21)14-17-6-3-5-16(2)13-17/h3,5-6,13,15,18H,4,7-12,14H2,1-2H3/p+1