3-[(2-bromanyl-4-fluoranyl-phenyl)methylazaniumyl]propyl-diethyl-azanium

Systemtic Name: 3-[(2-bromanyl-4-fluoranyl-phenyl)methylazaniumyl]propyl-diethyl-azanium Openeye Name: 3-[(2-bromo-4-fluoro-phenyl)methylammonio]propyl-diethyl-ammonium CAS Name: 3-[(2-bromo-4-fluorophenyl)methylammonio]propyl-diethylammonium IUPAC Name: 3-[(2-bromo-4-fluorophenyl)methylazaniumyl]propyl-diethylazanium Traditional Name: 3-[(2-bromo-4-fluoro-benzyl)ammonio]propyl-diethyl-ammonium Formula: C14H24BrFN2+2 MolecularWeight: 319.256163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22BrFN2/c1-3-18(4-2)9-5-8-17-11-12-6-7-13(16)10-14(12)15/h6-7,10,17H,3-5,8-9,11H2,1-2H3/p+2