N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[[4-(4-morpholin-4-iumylmethyl)phenyl]methyl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[4-(morpholin-4-ium-4-ylmethyl)benzyl]-3-(trifluoromethyl)benzenesulfonamide Formula: C19H22F3N2O3S+ MolecularWeight: 415.44979

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=C(C=C2)CNS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1COCC[NH+]1CC2=CC=C(C=C2)CNS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H21F3N2O3S/c20-19(21,22)17-2-1-3-18(12-17)28(25,26)23-13-15-4-6-16(7-5-15)14-24-8-10-27-11-9-24/h1-7,12,23H,8-11,13-14H2/p+1