[(S)-(5-bromanyl-2-fluoranyl-phenyl)-(4-tert-butylphenyl)methyl]azanium

Systemtic Name: [(S)-(5-bromanyl-2-fluoranyl-phenyl)-(4-tert-butylphenyl)methyl]azanium Openeye Name: [(S)-(5-bromo-2-fluoro-phenyl)-(4-tert-butylphenyl)methyl]ammonium CAS Name: [(S)-(5-bromo-2-fluorophenyl)-(4-tert-butylphenyl)methyl]ammonium IUPAC Name: [(S)-(5-bromo-2-fluorophenyl)-(4-tert-butylphenyl)methyl]azanium Traditional Name: [(S)-(5-bromo-2-fluoro-phenyl)-(4-tert-butylphenyl)methyl]ammonium Formula: C17H20BrFN+ MolecularWeight: 337.249803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(C2=C(C=CC(=C2)Br)F)[NH3+]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)[C@@H](C2=C(C=CC(=C2)Br)F)[NH3+]

InChI

InChI=1S/C17H19BrFN/c1-17(2,3)12-6-4-11(5-7-12)16(20)14-10-13(18)8-9-15(14)19/h4-10,16H,20H2,1-3H3/p+1/t16-/m0/s1