(3-chloranyl-2-fluoranyl-phenyl)-[(2S)-1-morpholin-4-yl-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (3-chloranyl-2-fluoranyl-phenyl)-[(2S)-1-morpholin-4-yl-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (3-chloro-2-fluoro-phenyl)-[(1S)-1-methyl-2-morpholino-2-oxo-ethyl]ammonium CAS Name: (3-chloro-2-fluorophenyl)-[(2S)-1-(4-morpholinyl)-1-oxopropan-2-yl]ammonium IUPAC Name: (3-chloro-2-fluorophenyl)-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]azanium Traditional Name: (3-chloro-2-fluoro-phenyl)-[(1S)-2-keto-1-methyl-2-morpholino-ethyl]ammonium Formula: C13H17ClFN2O2+ MolecularWeight: 287.737683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCOCC1)[NH2+]C2=C(C(=CC=C2)Cl)F

Isomeric SMILES

C[C@@H](C(=O)N1CCOCC1)[NH2+]C2=C(C(=CC=C2)Cl)F

InChI

InChI=1S/C13H16ClFN2O2/c1-9(13(18)17-5-7-19-8-6-17)16-11-4-2-3-10(14)12(11)15/h2-4,9,16H,5-8H2,1H3/p+1/t9-/m0/s1