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

Systemtic Name: 1-(4-ethanoylphenyl)sulfonyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]piperidine-4-carboxamide Openeye Name: 1-(4-acetylphenyl)sulfonyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]piperidine-4-carboxamide CAS Name: 1-(4-acetylphenyl)sulfonyl-N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-acetylphenyl)sulfonyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]piperidine-4-carboxamide Traditional Name: 1-(4-acetylphenyl)sulfonyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]isonipecotamide Formula: C23H36N3O4S+ MolecularWeight: 450.61464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H35N3O4S/c1-18-8-14-25(15-9-18)13-3-12-24-23(28)21-10-16-26(17-11-21)31(29,30)22-6-4-20(5-7-22)19(2)27/h4-7,18,21H,3,8-17H2,1-2H3,(H,24,28)/p+1