3,5-bis(fluoranyl)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]benzenesulfonamide

Systemtic Name: 3,5-bis(fluoranyl)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]benzenesulfonamide Openeye Name: 3,5-difluoro-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]benzenesulfonamide CAS Name: 3,5-difluoro-N-[(1S)-2-(4-morpholin-4-iumyl)-1-phenylethyl]benzenesulfonamide IUPAC Name: 3,5-difluoro-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]benzenesulfonamide Traditional Name: 3,5-difluoro-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]benzenesulfonamide Formula: C18H21F2N2O3S+ MolecularWeight: 383.432746

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(C2=CC=CC=C2)NS(=O)(=O)C3=CC(=CC(=C3)F)F

Isomeric SMILES

C1COCC[NH+]1C[C@H](C2=CC=CC=C2)NS(=O)(=O)C3=CC(=CC(=C3)F)F

InChI

InChI=1S/C18H20F2N2O3S/c19-15-10-16(20)12-17(11-15)26(23,24)21-18(14-4-2-1-3-5-14)13-22-6-8-25-9-7-22/h1-5,10-12,18,21H,6-9,13H2/p+1/t18-/m1/s1