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

Systemtic Name: [(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]-[(3-fluorophenyl)methyl]azanium Openeye Name: [(1S)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl]-[(3-fluorophenyl)methyl]ammonium CAS Name: [(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]-[(3-fluorophenyl)methyl]ammonium IUPAC Name: [(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]-[(3-fluorophenyl)methyl]azanium Traditional Name: [(1S)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl]-(3-fluorobenzyl)ammonium Formula: C13H18FN2O+ MolecularWeight: 237.293223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)[NH2+]CC2=CC(=CC=C2)F

Isomeric SMILES

C[C@@H](C(=O)NC1CC1)[NH2+]CC2=CC(=CC=C2)F

InChI

InChI=1S/C13H17FN2O/c1-9(13(17)16-12-5-6-12)15-8-10-3-2-4-11(14)7-10/h2-4,7,9,12,15H,5-6,8H2,1H3,(H,16,17)/p+1/t9-/m0/s1