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

Systemtic Name: 4-bromanyl-3-pentoxy-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenesulfonamide Openeye Name: 4-bromo-3-pentoxy-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenesulfonamide CAS Name: 4-bromo-3-pentoxy-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)benzenesulfonamide IUPAC Name: 4-bromo-3-pentoxy-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenesulfonamide Traditional Name: 3-amoxy-4-bromo-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenesulfonamide Formula: C20H34BrN2O3S+ MolecularWeight: 462.46456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC(=C1)S(=O)(=O)NC2CC([NH2+]C(C2)(C)C)(C)C)Br

Isomeric SMILES

CCCCCOC1=C(C=CC(=C1)S(=O)(=O)NC2CC([NH2+]C(C2)(C)C)(C)C)Br

InChI

InChI=1S/C20H33BrN2O3S/c1-6-7-8-11-26-18-12-16(9-10-17(18)21)27(24,25)22-15-13-19(2,3)23-20(4,5)14-15/h9-10,12,15,22-23H,6-8,11,13-14H2,1-5H3/p+1