4-chloranyl-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-2-(trifluoromethyl)benzenesulfonamide Openeye Name: 4-chloro-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-2-(trifluoromethyl)benzenesulfonamide CAS Name: 4-chloro-N-[(1S)-2-(4-morpholin-4-iumyl)-1-phenylethyl]-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: 4-chloro-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]-2-(trifluoromethyl)benzenesulfonamide Traditional Name: 4-chloro-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-2-(trifluoromethyl)benzenesulfonamide Formula: C19H21ClF3N2O3S+ MolecularWeight: 449.89485

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClF3N2O3S/c20-15-6-7-18(16(12-15)19(21,22)23)29(26,27)24-17(14-4-2-1-3-5-14)13-25-8-10-28-11-9-25/h1-7,12,17,24H,8-11,13H2/p+1/t17-/m1/s1