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

Systemtic Name: 5-bromanyl-2-ethoxy-N-[(2S)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]benzenesulfonamide Openeye Name: 5-bromo-2-ethoxy-N-[(2S)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]benzenesulfonamide CAS Name: 5-bromo-2-ethoxy-N-[(2S)-3-ethyl-2-(4-morpholin-4-iumyl)pentyl]benzenesulfonamide IUPAC Name: 5-bromo-2-ethoxy-N-[(2S)-3-ethyl-2-morpholin-4-ium-4-ylpentyl]benzenesulfonamide Traditional Name: 5-bromo-2-ethoxy-N-[(2S)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]benzenesulfonamide Formula: C19H32BrN2O4S+ MolecularWeight: 464.43738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H31BrN2O4S/c1-4-15(5-2)17(22-9-11-25-12-10-22)14-21-27(23,24)19-13-16(20)7-8-18(19)26-6-3/h7-8,13,15,17,21H,4-6,9-12,14H2,1-3H3/p+1/t17-/m1/s1