(3-bromanyl-4-fluoranyl-phenyl)methyl-[2-(dimethylazaniumyl)ethyl]-methyl-azanium

Systemtic Name: (3-bromanyl-4-fluoranyl-phenyl)methyl-[2-(dimethylazaniumyl)ethyl]-methyl-azanium Openeye Name: (3-bromo-4-fluoro-phenyl)methyl-[2-(dimethylammonio)ethyl]-methyl-ammonium CAS Name: (3-bromo-4-fluorophenyl)methyl-[2-(dimethylammonio)ethyl]-methylammonium IUPAC Name: (3-bromo-4-fluorophenyl)methyl-[2-(dimethylazaniumyl)ethyl]-methylazanium Traditional Name: (3-bromo-4-fluoro-benzyl)-[2-(dimethylammonio)ethyl]-methyl-ammonium Formula: C12H20BrFN2+2 MolecularWeight: 291.203003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18BrFN2/c1-15(2)6-7-16(3)9-10-4-5-12(14)11(13)8-10/h4-5,8H,6-7,9H2,1-3H3/p+2