(5-bromanyl-2-fluoranyl-phenyl)methyl-(2-methylbutan-2-yl)azanium

Systemtic Name: (5-bromanyl-2-fluoranyl-phenyl)methyl-(2-methylbutan-2-yl)azanium Openeye Name: (5-bromo-2-fluoro-phenyl)methyl-(1,1-dimethylpropyl)ammonium CAS Name: (5-bromo-2-fluorophenyl)methyl-(2-methylbutan-2-yl)ammonium IUPAC Name: (5-bromo-2-fluorophenyl)methyl-(2-methylbutan-2-yl)azanium Traditional Name: tert-amyl-(5-bromo-2-fluoro-benzyl)ammonium Formula: C12H18BrFN+ MolecularWeight: 275.180423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17BrFN/c1-4-12(2,3)15-8-9-7-10(13)5-6-11(9)14/h5-7,15H,4,8H2,1-3H3/p+1