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

Systemtic Name: 3-chloranyl-4-fluoranyl-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]benzenesulfonamide Openeye Name: 3-chloro-4-fluoro-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]benzenesulfonamide CAS Name: 3-chloro-4-fluoro-N-[(1R)-1-(4-methylphenyl)-2-(4-morpholin-4-iumyl)ethyl]benzenesulfonamide IUPAC Name: 3-chloro-4-fluoro-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]benzenesulfonamide Traditional Name: 3-chloro-4-fluoro-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]benzenesulfonamide Formula: C19H23ClFN2O3S+ MolecularWeight: 413.913923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[NH+]2CCOCC2)NS(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[NH+]2CCOCC2)NS(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C19H22ClFN2O3S/c1-14-2-4-15(5-3-14)19(13-23-8-10-26-11-9-23)22-27(24,25)16-6-7-18(21)17(20)12-16/h2-7,12,19,22H,8-11,13H2,1H3/p+1/t19-/m0/s1