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

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]piperidine-4-carboxamide Openeye Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]piperidine-4-carboxamide CAS Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]piperidine-4-carboxamide Traditional Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]isonipecotamide Formula: C21H33ClN3O3S+ MolecularWeight: 443.02302

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H32ClN3O3S/c1-17-7-13-24(14-8-17)12-2-11-23-21(26)18-9-15-25(16-10-18)29(27,28)20-5-3-19(22)4-6-20/h3-6,17-18H,2,7-16H2,1H3,(H,23,26)/p+1