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

Systemtic Name: [(S)-(5-bromanyl-2-fluoranyl-phenyl)-(4-propylphenyl)methyl]azanium Openeye Name: [(S)-(5-bromo-2-fluoro-phenyl)-(4-propylphenyl)methyl]ammonium CAS Name: [(S)-(5-bromo-2-fluorophenyl)-(4-propylphenyl)methyl]ammonium IUPAC Name: [(S)-(5-bromo-2-fluorophenyl)-(4-propylphenyl)methyl]azanium Traditional Name: [(S)-(5-bromo-2-fluoro-phenyl)-(4-propylphenyl)methyl]ammonium Formula: C16H18BrFN+ MolecularWeight: 323.223223

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C2=C(C=CC(=C2)Br)F)[NH3+]

Isomeric SMILES

CCCC1=CC=C(C=C1)[C@@H](C2=C(C=CC(=C2)Br)F)[NH3+]

InChI

InChI=1S/C16H17BrFN/c1-2-3-11-4-6-12(7-5-11)16(19)14-10-13(17)8-9-15(14)18/h4-10,16H,2-3,19H2,1H3/p+1/t16-/m0/s1