[(2R)-3-[4-bromanyl-2,6-bis(fluoranyl)phenoxy]-2-oxidanyl-propyl]-tert-butyl-azanium

Systemtic Name: [(2R)-3-[4-bromanyl-2,6-bis(fluoranyl)phenoxy]-2-oxidanyl-propyl]-tert-butyl-azanium Openeye Name: [(2R)-3-(4-bromo-2,6-difluoro-phenoxy)-2-hydroxy-propyl]-tert-butyl-ammonium CAS Name: [(2R)-3-(4-bromo-2,6-difluorophenoxy)-2-hydroxypropyl]-tert-butylammonium IUPAC Name: [(2R)-3-(4-bromo-2,6-difluorophenoxy)-2-hydroxypropyl]-tert-butylazanium Traditional Name: [(2R)-3-(4-bromo-2,6-difluoro-phenoxy)-2-hydroxy-propyl]-tert-butyl-ammonium Formula: C13H19BrF2NO2+ MolecularWeight: 339.196266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC(COC1=C(C=C(C=C1F)Br)F)O

Isomeric SMILES

CC(C)(C)[NH2+]C[C@H](COC1=C(C=C(C=C1F)Br)F)O

InChI

InChI=1S/C13H18BrF2NO2/c1-13(2,3)17-6-9(18)7-19-12-10(15)4-8(14)5-11(12)16/h4-5,9,17-18H,6-7H2,1-3H3/p+1/t9-/m1/s1