4-bromanyl-3-propoxy-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenesulfonamide

Systemtic Name: 4-bromanyl-3-propoxy-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenesulfonamide Openeye Name: 4-bromo-3-propoxy-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenesulfonamide CAS Name: 4-bromo-3-propoxy-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)benzenesulfonamide IUPAC Name: 4-bromo-3-propoxy-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenesulfonamide Traditional Name: 4-bromo-3-propoxy-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenesulfonamide Formula: C18H30BrN2O3S+ MolecularWeight: 434.4114

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)S(=O)(=O)NC2CC([NH2+]C(C2)(C)C)(C)C)Br

Isomeric SMILES

CCCOC1=C(C=CC(=C1)S(=O)(=O)NC2CC([NH2+]C(C2)(C)C)(C)C)Br

InChI

InChI=1S/C18H29BrN2O3S/c1-6-9-24-16-10-14(7-8-15(16)19)25(22,23)20-13-11-17(2,3)21-18(4,5)12-13/h7-8,10,13,20-21H,6,9,11-12H2,1-5H3/p+1