[(1S)-1-[2-(2-bromanyl-4-methyl-phenoxy)-5-fluoranyl-phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[2-(2-bromanyl-4-methyl-phenoxy)-5-fluoranyl-phenyl]ethyl]azanium Openeye Name: [(1S)-1-[2-(2-bromo-4-methyl-phenoxy)-5-fluoro-phenyl]ethyl]ammonium CAS Name: [(1S)-1-[2-(2-bromo-4-methylphenoxy)-5-fluorophenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[2-(2-bromo-4-methylphenoxy)-5-fluorophenyl]ethyl]azanium Traditional Name: [(1S)-1-[2-(2-bromo-4-methyl-phenoxy)-5-fluoro-phenyl]ethyl]ammonium Formula: C15H16BrFNO+ MolecularWeight: 325.196043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=C(C=C(C=C2)F)C(C)[NH3+])Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=C(C=C(C=C2)F)[C@H](C)[NH3+])Br

InChI

InChI=1S/C15H15BrFNO/c1-9-3-5-15(13(16)7-9)19-14-6-4-11(17)8-12(14)10(2)18/h3-8,10H,18H2,1-2H3/p+1/t10-/m0/s1