3-chloranyl-4-fluoranyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]benzenesulfonamide

Systemtic Name: 3-chloranyl-4-fluoranyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]benzenesulfonamide Openeye Name: 3-chloro-4-fluoro-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]benzenesulfonamide CAS Name: 3-chloro-4-fluoro-N-[(1R)-2-(4-morpholin-4-iumyl)-1-phenylethyl]benzenesulfonamide IUPAC Name: 3-chloro-4-fluoro-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]benzenesulfonamide Traditional Name: 3-chloro-4-fluoro-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]benzenesulfonamide Formula: C18H21ClFN2O3S+ MolecularWeight: 399.887343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClFN2O3S/c19-16-12-15(6-7-17(16)20)26(23,24)21-18(14-4-2-1-3-5-14)13-22-8-10-25-11-9-22/h1-7,12,18,21H,8-11,13H2/p+1/t18-/m0/s1