(4-fluorophenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)[NH+](C)CC2=CC=C(C=C2)F

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)[NH+](C)CC2=CC=C(C=C2)F

InChI

InChI=1S/C17H19FN2O/c1-13(17(21)19-16-6-4-3-5-7-16)20(2)12-14-8-10-15(18)11-9-14/h3-11,13H,12H2,1-2H3,(H,19,21)/p+1/t13-/m1/s1