N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-4-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-4-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-4-(trifluoromethyl)benzenesulfonamide CAS Name: N-[(2R)-3-methyl-2-(4-morpholin-4-iumyl)butyl]-4-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-ylbutyl]-4-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-4-(trifluoromethyl)benzenesulfonamide Formula: C16H24F3N2O3S+ MolecularWeight: 381.43357

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNS(=O)(=O)C1=CC=C(C=C1)C(F)(F)F)[NH+]2CCOCC2

Isomeric SMILES

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

InChI

InChI=1S/C16H23F3N2O3S/c1-12(2)15(21-7-9-24-10-8-21)11-20-25(22,23)14-5-3-13(4-6-14)16(17,18)19/h3-6,12,15,20H,7-11H2,1-2H3/p+1/t15-/m0/s1