(5-bromanyl-2-fluoranyl-phenyl)methyl-[2-(dimethylamino)-2-methyl-propyl]azanium

Systemtic Name: (5-bromanyl-2-fluoranyl-phenyl)methyl-[2-(dimethylamino)-2-methyl-propyl]azanium Openeye Name: (5-bromo-2-fluoro-phenyl)methyl-[2-(dimethylamino)-2-methyl-propyl]ammonium CAS Name: (5-bromo-2-fluorophenyl)methyl-[2-(dimethylamino)-2-methylpropyl]ammonium IUPAC Name: (5-bromo-2-fluorophenyl)methyl-[2-(dimethylamino)-2-methylpropyl]azanium Traditional Name: (5-bromo-2-fluoro-benzyl)-[2-(dimethylamino)-2-methyl-propyl]ammonium Formula: C13H21BrFN2+ MolecularWeight: 304.221643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20BrFN2/c1-13(2,17(3)4)9-16-8-10-7-11(14)5-6-12(10)15/h5-7,16H,8-9H2,1-4H3/p+1