[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]-methyl-[[4-(trifluoromethyloxy)phenyl]methyl]azanium

Systemtic Name: [(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]-methyl-[[4-(trifluoromethyloxy)phenyl]methyl]azanium Openeye Name: [(1S)-2-amino-1-methyl-2-oxo-ethyl]-methyl-[[4-(trifluoromethoxy)phenyl]methyl]ammonium CAS Name: [(2S)-1-amino-1-oxopropan-2-yl]-methyl-[[4-(trifluoromethoxy)phenyl]methyl]ammonium IUPAC Name: [(2S)-1-amino-1-oxopropan-2-yl]-methyl-[[4-(trifluoromethoxy)phenyl]methyl]azanium Traditional Name: [(1S)-2-amino-2-keto-1-methyl-ethyl]-methyl-[4-(trifluoromethoxy)benzyl]ammonium Formula: C12H16F3N2O2+ MolecularWeight: 277.26285

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)[NH+](C)CC1=CC=C(C=C1)OC(F)(F)F

Isomeric SMILES

C[C@@H](C(=O)N)[NH+](C)CC1=CC=C(C=C1)OC(F)(F)F

InChI

InChI=1S/C12H15F3N2O2/c1-8(11(16)18)17(2)7-9-3-5-10(6-4-9)19-12(13,14)15/h3-6,8H,7H2,1-2H3,(H2,16,18)/p+1/t8-/m0/s1