N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C22H33F3N3O3S+ MolecularWeight: 476.57593

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1CC[NH+](CC1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H32F3N3O3S/c1-17-6-12-27(13-7-17)11-3-10-26-21(29)18-8-14-28(15-9-18)32(30,31)20-5-2-4-19(16-20)22(23,24)25/h2,4-5,16-18H,3,6-15H2,1H3,(H,26,29)/p+1