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

Systemtic Name: 1-[2,6-bis(chloranyl)phenyl]sulfonyl-N-(1-methylpiperidin-1-ium-4-yl)piperidine-4-carboxamide Openeye Name: 1-(2,6-dichlorophenyl)sulfonyl-N-(1-methylpiperidin-1-ium-4-yl)piperidine-4-carboxamide CAS Name: 1-(2,6-dichlorophenyl)sulfonyl-N-(1-methyl-4-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-(2,6-dichlorophenyl)sulfonyl-N-(1-methylpiperidin-1-ium-4-yl)piperidine-4-carboxamide Traditional Name: 1-(2,6-dichlorophenyl)sulfonyl-N-(1-methylpiperidin-1-ium-4-yl)isonipecotamide Formula: C18H26Cl2N3O3S+ MolecularWeight: 435.38834

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC=C3Cl)Cl

Isomeric SMILES

C[NH+]1CCC(CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C18H25Cl2N3O3S/c1-22-9-7-14(8-10-22)21-18(24)13-5-11-23(12-6-13)27(25,26)17-15(19)3-2-4-16(17)20/h2-4,13-14H,5-12H2,1H3,(H,21,24)/p+1