(4-bromanyl-2-fluoranyl-phenyl)methyl-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-bromo-2-fluoro-phenyl)methyl-[2-(cyclopropylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-bromo-2-fluorophenyl)methyl-[2-(cyclopropylamino)-2-oxoethyl]-methylammonium IUPAC Name: (4-bromo-2-fluorophenyl)methyl-[2-(cyclopropylamino)-2-oxoethyl]-methylazanium Traditional Name: (4-bromo-2-fluoro-benzyl)-[2-(cyclopropylamino)-2-keto-ethyl]-methyl-ammonium Formula: C13H17BrFN2O+ MolecularWeight: 316.189283

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C=C(C=C1)Br)F)CC(=O)NC2CC2

Isomeric SMILES

C[NH+](CC1=C(C=C(C=C1)Br)F)CC(=O)NC2CC2

InChI

InChI=1S/C13H16BrFN2O/c1-17(8-13(18)16-11-4-5-11)7-9-2-3-10(14)6-12(9)15/h2-3,6,11H,4-5,7-8H2,1H3,(H,16,18)/p+1