2-[(2-bromanyl-4-fluoranyl-phenyl)methylsulfanyl]ethylazanium

Systemtic Name: 2-[(2-bromanyl-4-fluoranyl-phenyl)methylsulfanyl]ethylazanium Openeye Name: 2-[(2-bromo-4-fluoro-phenyl)methylsulfanyl]ethylammonium CAS Name: 2-[(2-bromo-4-fluorophenyl)methylthio]ethylammonium IUPAC Name: 2-[(2-bromo-4-fluorophenyl)methylsulfanyl]ethylazanium Traditional Name: 2-[(2-bromo-4-fluoro-benzyl)thio]ethylammonium Formula: C9H12BrFNS+ MolecularWeight: 265.165683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)Br)CSCC[NH3+]

Isomeric SMILES

C1=CC(=C(C=C1F)Br)CSCC[NH3+]

InChI

InChI=1S/C9H11BrFNS/c10-9-5-8(11)2-1-7(9)6-13-4-3-12/h1-2,5H,3-4,6,12H2/p+1