[(2S)-4-methyl-1-oxidanylidene-1-[[2-(trifluoromethyl)phenyl]amino]pentan-2-yl]azanium

Systemtic Name: [(2S)-4-methyl-1-oxidanylidene-1-[[2-(trifluoromethyl)phenyl]amino]pentan-2-yl]azanium Openeye Name: [(1S)-3-methyl-1-[[2-(trifluoromethyl)phenyl]carbamoyl]butyl]ammonium CAS Name: [(2S)-4-methyl-1-oxo-1-[2-(trifluoromethyl)anilino]pentan-2-yl]ammonium IUPAC Name: [(2S)-4-methyl-1-oxo-1-[2-(trifluoromethyl)anilino]pentan-2-yl]azanium Traditional Name: [(1S)-3-methyl-1-[[2-(trifluoromethyl)phenyl]carbamoyl]butyl]ammonium Formula: C13H18F3N2O+ MolecularWeight: 275.29003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=CC=C1C(F)(F)F)[NH3+]

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1=CC=CC=C1C(F)(F)F)[NH3+]

InChI

InChI=1S/C13H17F3N2O/c1-8(2)7-10(17)12(19)18-11-6-4-3-5-9(11)13(14,15)16/h3-6,8,10H,7,17H2,1-2H3,(H,18,19)/p+1/t10-/m0/s1