3-[(3-bromanyl-4-fluoranyl-phenyl)methylazaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[(3-bromanyl-4-fluoranyl-phenyl)methylazaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[(3-bromo-4-fluoro-phenyl)methylammonio]propyl-dimethyl-ammonium CAS Name: 3-[(3-bromo-4-fluorophenyl)methylammonio]propyl-dimethylammonium IUPAC Name: 3-[(3-bromo-4-fluorophenyl)methylazaniumyl]propyl-dimethylazanium Traditional Name: 3-[(3-bromo-4-fluoro-benzyl)ammonio]propyl-dimethyl-ammonium Formula: C12H20BrFN2+2 MolecularWeight: 291.203003

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH2+]CC1=CC(=C(C=C1)F)Br

Isomeric SMILES

C[NH+](C)CCC[NH2+]CC1=CC(=C(C=C1)F)Br

InChI

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