3-bromanyl-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]benzenesulfonamide

Systemtic Name: 3-bromanyl-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]benzenesulfonamide Openeye Name: 3-bromo-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]benzenesulfonamide CAS Name: 3-bromo-N-[(2R)-3-ethyl-2-(4-morpholin-4-iumyl)pentyl]benzenesulfonamide IUPAC Name: 3-bromo-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-ylpentyl]benzenesulfonamide Traditional Name: 3-bromo-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]benzenesulfonamide Formula: C17H28BrN2O3S+ MolecularWeight: 420.38482

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNS(=O)(=O)C1=CC(=CC=C1)Br)[NH+]2CCOCC2

Isomeric SMILES

CCC(CC)[C@H](CNS(=O)(=O)C1=CC(=CC=C1)Br)[NH+]2CCOCC2

InChI

InChI=1S/C17H27BrN2O3S/c1-3-14(4-2)17(20-8-10-23-11-9-20)13-19-24(21,22)16-7-5-6-15(18)12-16/h5-7,12,14,17,19H,3-4,8-11,13H2,1-2H3/p+1/t17-/m0/s1