[(1S)-2-[(5-bromanyl-2-fluoranyl-phenyl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(5-bromanyl-2-fluoranyl-phenyl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(5-bromo-2-fluoro-benzoyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(5-bromo-2-fluorophenyl)-oxomethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(5-bromo-2-fluorobenzoyl)amino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-[(5-bromo-2-fluoro-benzoyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C17H19BrFN2O+ MolecularWeight: 366.247963

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=C(C=CC(=C1)Br)F)C2=CC=CC=C2

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=C(C=CC(=C1)Br)F)C2=CC=CC=C2

InChI

InChI=1S/C17H18BrFN2O/c1-21(2)16(12-6-4-3-5-7-12)11-20-17(22)14-10-13(18)8-9-15(14)19/h3-10,16H,11H2,1-2H3,(H,20,22)/p+1/t16-/m1/s1