[(2S)-1-[(5-azanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-dimethyl-azanium

Systemtic Name: [(2S)-1-[(5-azanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-dimethyl-azanium Openeye Name: [(1S)-2-(5-amino-2-fluoro-anilino)-1-methyl-2-oxo-ethyl]-dimethyl-ammonium CAS Name: [(2S)-1-(5-amino-2-fluoroanilino)-1-oxopropan-2-yl]-dimethylammonium IUPAC Name: [(2S)-1-(5-amino-2-fluoroanilino)-1-oxopropan-2-yl]-dimethylazanium Traditional Name: [(1S)-2-(5-amino-2-fluoro-anilino)-2-keto-1-methyl-ethyl]-dimethyl-ammonium Formula: C11H17FN3O+ MolecularWeight: 226.270583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)N)F)[NH+](C)C

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=CC(=C1)N)F)[NH+](C)C

InChI

InChI=1S/C11H16FN3O/c1-7(15(2)3)11(16)14-10-6-8(13)4-5-9(10)12/h4-7H,13H2,1-3H3,(H,14,16)/p+1/t7-/m0/s1