[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]-[(4-fluorophenyl)methyl]azanium

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]-[(4-fluorophenyl)methyl]azanium Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl]-[(4-fluorophenyl)methyl]ammonium CAS Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl]-[(4-fluorophenyl)methyl]ammonium IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl]-[(4-fluorophenyl)methyl]azanium Traditional Name: [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl]-(4-fluorobenzyl)ammonium Formula: C12H18FN2O+ MolecularWeight: 225.282523

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)[NH2+]CC1=CC=C(C=C1)F

Isomeric SMILES

CCNC(=O)[C@H](C)[NH2+]CC1=CC=C(C=C1)F

InChI

InChI=1S/C12H17FN2O/c1-3-14-12(16)9(2)15-8-10-4-6-11(13)7-5-10/h4-7,9,15H,3,8H2,1-2H3,(H,14,16)/p+1/t9-/m0/s1