N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-isonipecotamide Formula: C25H42N3O3S+ MolecularWeight: 464.68428

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C(=CC(=C3C)C)C)C

Isomeric SMILES

CC1CC[NH+](CC1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C(=CC(=C3C)C)C)C

InChI

InChI=1S/C25H41N3O3S/c1-18-7-13-27(14-8-18)12-6-11-26-25(29)23-9-15-28(16-10-23)32(30,31)24-21(4)19(2)17-20(3)22(24)5/h17-18,23H,6-16H2,1-5H3,(H,26,29)/p+1