[(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]-[(3-fluorophenyl)methyl]azanium

Systemtic Name: [(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]-[(3-fluorophenyl)methyl]azanium Openeye Name: [(1S)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]-[(3-fluorophenyl)methyl]ammonium CAS Name: [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]-[(3-fluorophenyl)methyl]ammonium IUPAC Name: [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]-[(3-fluorophenyl)methyl]azanium Traditional Name: [(1S)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl]-(3-fluorobenzyl)ammonium Formula: C16H24FN2O+ MolecularWeight: 279.372963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)[NH2+]CC2=CC(=CC=C2)F

Isomeric SMILES

C[C@@H](C(=O)NC1CCCCC1)[NH2+]CC2=CC(=CC=C2)F

InChI

InChI=1S/C16H23FN2O/c1-12(16(20)19-15-8-3-2-4-9-15)18-11-13-6-5-7-14(17)10-13/h5-7,10,12,15,18H,2-4,8-9,11H2,1H3,(H,19,20)/p+1/t12-/m0/s1