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

Systemtic Name: 3-methyl-4-pentoxy-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenesulfonamide Openeye Name: 3-methyl-4-pentoxy-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenesulfonamide CAS Name: 3-methyl-4-pentoxy-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)benzenesulfonamide IUPAC Name: 3-methyl-4-pentoxy-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenesulfonamide Traditional Name: 4-amoxy-3-methyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenesulfonamide Formula: C21H37N2O3S+ MolecularWeight: 397.59508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H36N2O3S/c1-7-8-9-12-26-19-11-10-18(13-16(19)2)27(24,25)22-17-14-20(3,4)23-21(5,6)15-17/h10-11,13,17,22-23H,7-9,12,14-15H2,1-6H3/p+1