[(2S)-3-(2-bromanyl-4-fluoranyl-phenoxy)-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: [(2S)-3-(2-bromanyl-4-fluoranyl-phenoxy)-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2S)-3-(2-bromo-4-fluoro-phenoxy)-2-hydroxy-propyl]-methyl-ammonium CAS Name: [(2S)-3-(2-bromo-4-fluorophenoxy)-2-hydroxypropyl]-methylammonium IUPAC Name: [(2S)-3-(2-bromo-4-fluorophenoxy)-2-hydroxypropyl]-methylazanium Traditional Name: [(2S)-3-(2-bromo-4-fluoro-phenoxy)-2-hydroxy-propyl]-methyl-ammonium Formula: C10H14BrFNO2+ MolecularWeight: 279.126063

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(COC1=C(C=C(C=C1)F)Br)O

Isomeric SMILES

C[NH2+]C[C@@H](COC1=C(C=C(C=C1)F)Br)O

InChI

InChI=1S/C10H13BrFNO2/c1-13-5-8(14)6-15-10-3-2-7(12)4-9(10)11/h2-4,8,13-14H,5-6H2,1H3/p+1/t8-/m0/s1