3-morpholin-4-ium-4-ylpropyl-[2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl]azanium

Systemtic Name: 3-morpholin-4-ium-4-ylpropyl-[2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl]azanium Openeye Name: 3-morpholin-4-ium-4-ylpropyl-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]ammonium CAS Name: 3-(4-morpholin-4-iumyl)propyl-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]ammonium IUPAC Name: 3-morpholin-4-ium-4-ylpropyl-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]azanium Traditional Name: [2-keto-2-[4-(trifluoromethoxy)anilino]ethyl]-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C16H24F3N3O3+2 MolecularWeight: 363.37527

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCC[NH2+]CC(=O)NC2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

C1COCC[NH+]1CCC[NH2+]CC(=O)NC2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C16H22F3N3O3/c17-16(18,19)25-14-4-2-13(3-5-14)21-15(23)12-20-6-1-7-22-8-10-24-11-9-22/h2-5,20H,1,6-12H2,(H,21,23)/p+2