[(2S)-3-ethoxy-3-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]methyl]propyl]azanium

Systemtic Name: [(2S)-3-ethoxy-3-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]methyl]propyl]azanium Openeye Name: [(2S)-3-ethoxy-3-oxo-2-[[4-(trifluoromethoxy)phenyl]methyl]propyl]ammonium CAS Name: [(2S)-3-ethoxy-3-oxo-2-[[4-(trifluoromethoxy)phenyl]methyl]propyl]ammonium IUPAC Name: [(2S)-3-ethoxy-3-oxo-2-[[4-(trifluoromethoxy)phenyl]methyl]propyl]azanium Traditional Name: [(2S)-3-ethoxy-3-keto-2-[4-(trifluoromethoxy)benzyl]propyl]ammonium Formula: C13H17F3NO3+ MolecularWeight: 292.27419

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)OC(F)(F)F)C[NH3+]

Isomeric SMILES

CCOC(=O)[C@@H](CC1=CC=C(C=C1)OC(F)(F)F)C[NH3+]

InChI

InChI=1S/C13H16F3NO3/c1-2-19-12(18)10(8-17)7-9-3-5-11(6-4-9)20-13(14,15)16/h3-6,10H,2,7-8,17H2,1H3/p+1/t10-/m0/s1