N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: 1-mesyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]nipecotamide Formula: C16H32N3O3S+ MolecularWeight: 346.50858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNC(=O)C2CCCN(C2)S(=O)(=O)C

Isomeric SMILES

CC1CC[NH+](CC1)CCCNC(=O)C2CCCN(C2)S(=O)(=O)C

InChI

InChI=1S/C16H31N3O3S/c1-14-6-11-18(12-7-14)9-4-8-17-16(20)15-5-3-10-19(13-15)23(2,21)22/h14-15H,3-13H2,1-2H3,(H,17,20)/p+1