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

Systemtic Name: 3-morpholin-4-ium-4-ylpropyl-[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl]azanium Openeye Name: 3-morpholin-4-ium-4-ylpropyl-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]ammonium CAS Name: 3-(4-morpholin-4-iumyl)propyl-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]ammonium IUPAC Name: 3-morpholin-4-ium-4-ylpropyl-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]azanium Traditional Name: [2-keto-2-[3-(trifluoromethyl)anilino]ethyl]-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C16H24F3N3O2+2 MolecularWeight: 347.37587

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22F3N3O2/c17-16(18,19)13-3-1-4-14(11-13)21-15(23)12-20-5-2-6-22-7-9-24-10-8-22/h1,3-4,11,20H,2,5-10,12H2,(H,21,23)/p+2