2-(4-fluorophenyl)ethyl-[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium

Systemtic Name: 2-(4-fluorophenyl)ethyl-[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium Openeye Name: [(1S)-2-anilino-1-methyl-2-oxo-ethyl]-[2-(4-fluorophenyl)ethyl]ammonium CAS Name: [(2S)-1-anilino-1-oxopropan-2-yl]-[2-(4-fluorophenyl)ethyl]ammonium IUPAC Name: [(2S)-1-anilino-1-oxopropan-2-yl]-[2-(4-fluorophenyl)ethyl]azanium Traditional Name: [(1S)-2-anilino-2-keto-1-methyl-ethyl]-[2-(4-fluorophenyl)ethyl]ammonium Formula: C17H20FN2O+ MolecularWeight: 287.351903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)[NH2+]CCC2=CC=C(C=C2)F

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1)[NH2+]CCC2=CC=C(C=C2)F

InChI

InChI=1S/C17H19FN2O/c1-13(17(21)20-16-5-3-2-4-6-16)19-12-11-14-7-9-15(18)10-8-14/h2-10,13,19H,11-12H2,1H3,(H,20,21)/p+1/t13-/m0/s1