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

Systemtic Name: 5-bromanyl-2-methoxy-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide Openeye Name: 5-bromo-2-methoxy-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide CAS Name: 5-bromo-2-methoxy-N-[3-(1-piperidin-1-iumyl)propyl]benzenesulfonamide IUPAC Name: 5-bromo-2-methoxy-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide Traditional Name: 5-bromo-2-methoxy-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide Formula: C15H24BrN2O3S+ MolecularWeight: 392.33166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)NCCC[NH+]2CCCCC2

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)NCCC[NH+]2CCCCC2

InChI

InChI=1S/C15H23BrN2O3S/c1-21-14-7-6-13(16)12-15(14)22(19,20)17-8-5-11-18-9-3-2-4-10-18/h6-7,12,17H,2-5,8-11H2,1H3/p+1