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

Systemtic Name: [(2R)-3-[4-bromanyl-2,6-bis(fluoranyl)phenoxy]-2-oxidanyl-propyl]-propan-2-yl-azanium Openeye Name: [(2R)-3-(4-bromo-2,6-difluoro-phenoxy)-2-hydroxy-propyl]-isopropyl-ammonium CAS Name: [(2R)-3-(4-bromo-2,6-difluorophenoxy)-2-hydroxypropyl]-propan-2-ylammonium IUPAC Name: [(2R)-3-(4-bromo-2,6-difluorophenoxy)-2-hydroxypropyl]-propan-2-ylazanium Traditional Name: [(2R)-3-(4-bromo-2,6-difluoro-phenoxy)-2-hydroxy-propyl]-isopropyl-ammonium Formula: C12H17BrF2NO2+ MolecularWeight: 325.169686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16BrF2NO2/c1-7(2)16-5-9(17)6-18-12-10(14)3-8(13)4-11(12)15/h3-4,7,9,16-17H,5-6H2,1-2H3/p+1/t9-/m1/s1