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

Systemtic Name: N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]-4-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]-4-(trifluoromethyl)benzenesulfonamide CAS Name: N-[(1R)-1-(4-methylphenyl)-2-(4-morpholin-4-iumyl)ethyl]-4-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]-4-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]-4-(trifluoromethyl)benzenesulfonamide Formula: C20H24F3N2O3S+ MolecularWeight: 429.47637

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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)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C20H23F3N2O3S/c1-15-2-4-16(5-3-15)19(14-25-10-12-28-13-11-25)24-29(26,27)18-8-6-17(7-9-18)20(21,22)23/h2-9,19,24H,10-14H2,1H3/p+1/t19-/m0/s1