4-chloranyl-N-(furan-2-ylmethyl)-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(furan-2-ylmethyl)-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide Openeye Name: 4-chloro-N-(2-furylmethyl)-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide CAS Name: 4-chloro-N-(2-furanylmethyl)-N-(1-methyl-4-piperidin-1-iumyl)benzenesulfonamide IUPAC Name: 4-chloro-N-(furan-2-ylmethyl)-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide Traditional Name: 4-chloro-N-(2-furfuryl)-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide Formula: C17H22ClN2O3S+ MolecularWeight: 369.88618

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(CC2=CC=CO2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C[NH+]1CCC(CC1)N(CC2=CC=CO2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H21ClN2O3S/c1-19-10-8-15(9-11-19)20(13-16-3-2-12-23-16)24(21,22)17-6-4-14(18)5-7-17/h2-7,12,15H,8-11,13H2,1H3/p+1