(4-bromanyl-2-fluoranyl-phenyl)-[(2S)-1-(dimethylamino)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)-[(2S)-1-(dimethylamino)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (4-bromo-2-fluoro-phenyl)-[(1S)-2-(dimethylamino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: (4-bromo-2-fluorophenyl)-[(2S)-1-(dimethylamino)-1-oxopropan-2-yl]ammonium IUPAC Name: (4-bromo-2-fluorophenyl)-[(2S)-1-(dimethylamino)-1-oxopropan-2-yl]azanium Traditional Name: (4-bromo-2-fluoro-phenyl)-[(1S)-2-(dimethylamino)-2-keto-1-methyl-ethyl]ammonium Formula: C11H15BrFN2O+ MolecularWeight: 290.152003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C)[NH2+]C1=C(C=C(C=C1)Br)F

Isomeric SMILES

C[C@@H](C(=O)N(C)C)[NH2+]C1=C(C=C(C=C1)Br)F

InChI

InChI=1S/C11H14BrFN2O/c1-7(11(16)15(2)3)14-10-5-4-8(12)6-9(10)13/h4-7,14H,1-3H3/p+1/t7-/m0/s1