5-bromanyl-2-methyl-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide

Systemtic Name: 5-bromanyl-2-methyl-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide Openeye Name: 5-bromo-2-methyl-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide CAS Name: 5-bromo-2-methyl-N-[3-(1-piperidin-1-iumyl)propyl]benzenesulfonamide IUPAC Name: 5-bromo-2-methyl-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide Traditional Name: 5-bromo-2-methyl-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide Formula: C15H24BrN2O2S+ MolecularWeight: 376.33226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)S(=O)(=O)NCCC[NH+]2CCCCC2

Isomeric SMILES

CC1=C(C=C(C=C1)Br)S(=O)(=O)NCCC[NH+]2CCCCC2

InChI

InChI=1S/C15H23BrN2O2S/c1-13-6-7-14(16)12-15(13)21(19,20)17-8-5-11-18-9-3-2-4-10-18/h6-7,12,17H,2-5,8-11H2,1H3/p+1