[4-oxidanylidene-4-[[3-(trifluoromethyl)phenyl]methylamino]butyl]azanium

Systemtic Name: [4-oxidanylidene-4-[[3-(trifluoromethyl)phenyl]methylamino]butyl]azanium Openeye Name: [4-oxo-4-[[3-(trifluoromethyl)phenyl]methylamino]butyl]ammonium CAS Name: [4-oxo-4-[[3-(trifluoromethyl)phenyl]methylamino]butyl]ammonium IUPAC Name: [4-oxo-4-[[3-(trifluoromethyl)phenyl]methylamino]butyl]azanium Traditional Name: [4-keto-4-[[3-(trifluoromethyl)benzyl]amino]butyl]ammonium Formula: C12H16F3N2O+ MolecularWeight: 261.26345

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)CCC[NH3+]

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)CCC[NH3+]

InChI

InChI=1S/C12H15F3N2O/c13-12(14,15)10-4-1-3-9(7-10)8-17-11(18)5-2-6-16/h1,3-4,7H,2,5-6,8,16H2,(H,17,18)/p+1