[(2S)-3-(2-bromanylphenoxy)-2-oxidanyl-propyl]-ethyl-azanium

Systemtic Name: [(2S)-3-(2-bromanylphenoxy)-2-oxidanyl-propyl]-ethyl-azanium Openeye Name: [(2S)-3-(2-bromophenoxy)-2-hydroxy-propyl]-ethyl-ammonium CAS Name: [(2S)-3-(2-bromophenoxy)-2-hydroxypropyl]-ethylammonium IUPAC Name: [(2S)-3-(2-bromophenoxy)-2-hydroxypropyl]-ethylazanium Traditional Name: [(2S)-3-(2-bromophenoxy)-2-hydroxy-propyl]-ethyl-ammonium Formula: C11H17BrNO2+ MolecularWeight: 275.16218

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CC(COC1=CC=CC=C1Br)O

Isomeric SMILES

CC[NH2+]C[C@@H](COC1=CC=CC=C1Br)O

InChI

InChI=1S/C11H16BrNO2/c1-2-13-7-9(14)8-15-11-6-4-3-5-10(11)12/h3-6,9,13-14H,2,7-8H2,1H3/p+1/t9-/m0/s1