1-morpholin-4-yl-3-[1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-yl]propan-1-one

Systemtic Name: 1-morpholin-4-yl-3-[1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-yl]propan-1-one Openeye Name: 1-morpholino-3-[1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-yl]propan-1-one CAS Name: 1-(4-morpholinyl)-3-[1-[[4-(trifluoromethyl)phenyl]methyl]-4-piperidin-1-iumyl]-1-propanone IUPAC Name: 1-morpholin-4-yl-3-[1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-yl]propan-1-one Traditional Name: 1-morpholino-3-[1-[4-(trifluoromethyl)benzyl]piperidin-1-ium-4-yl]propan-1-one Formula: C20H28F3N2O2+ MolecularWeight: 385.44373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CCC(=O)N2CCOCC2)CC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1C[NH+](CCC1CCC(=O)N2CCOCC2)CC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H27F3N2O2/c21-20(22,23)18-4-1-17(2-5-18)15-24-9-7-16(8-10-24)3-6-19(26)25-11-13-27-14-12-25/h1-2,4-5,16H,3,6-15H2/p+1