3-azanyl-4-chloranyl-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide

Systemtic Name: 3-azanyl-4-chloranyl-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide Openeye Name: 3-amino-4-chloro-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide CAS Name: 3-amino-4-chloro-N-methyl-N-(1-methyl-4-piperidin-1-iumyl)benzenesulfonamide IUPAC Name: 3-amino-4-chloro-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide Traditional Name: 3-amino-4-chloro-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide Formula: C13H21ClN3O2S+ MolecularWeight: 318.84274

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)S(=O)(=O)C2=CC(=C(C=C2)Cl)N

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)S(=O)(=O)C2=CC(=C(C=C2)Cl)N

InChI

InChI=1S/C13H20ClN3O2S/c1-16-7-5-10(6-8-16)17(2)20(18,19)11-3-4-12(14)13(15)9-11/h3-4,9-10H,5-8,15H2,1-2H3/p+1