1-[2,6-bis(chloranyl)phenyl]sulfonyl-N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)piperidine-4-carboxamide

Systemtic Name: 1-[2,6-bis(chloranyl)phenyl]sulfonyl-N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)piperidine-4-carboxamide Openeye Name: 1-(2,6-dichlorophenyl)sulfonyl-N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)piperidine-4-carboxamide CAS Name: 1-(2,6-dichlorophenyl)sulfonyl-N-[2-methyl-2-(1-piperidin-1-iumyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,6-dichlorophenyl)sulfonyl-N-(2-methyl-2-piperidin-1-ium-1-ylpropyl)piperidine-4-carboxamide Traditional Name: 1-(2,6-dichlorophenyl)sulfonyl-N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)isonipecotamide Formula: C21H32Cl2N3O3S+ MolecularWeight: 477.46808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=CC=C2Cl)Cl)[NH+]3CCCCC3

Isomeric SMILES

CC(C)(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=CC=C2Cl)Cl)[NH+]3CCCCC3

InChI

InChI=1S/C21H31Cl2N3O3S/c1-21(2,25-11-4-3-5-12-25)15-24-20(27)16-9-13-26(14-10-16)30(28,29)19-17(22)7-6-8-18(19)23/h6-8,16H,3-5,9-15H2,1-2H3,(H,24,27)/p+1