[(3S)-4-(4-bromanylphenoxy)-3-oxidanyl-butyl]azanium

Systemtic Name: [(3S)-4-(4-bromanylphenoxy)-3-oxidanyl-butyl]azanium Openeye Name: [(3S)-4-(4-bromophenoxy)-3-hydroxy-butyl]ammonium CAS Name: [(3S)-4-(4-bromophenoxy)-3-hydroxybutyl]ammonium IUPAC Name: [(3S)-4-(4-bromophenoxy)-3-hydroxybutyl]azanium Traditional Name: [(3S)-4-(4-bromophenoxy)-3-hydroxy-butyl]ammonium Formula: C10H15BrNO2+ MolecularWeight: 261.1356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC(CC[NH3+])O)Br

Isomeric SMILES

C1=CC(=CC=C1OC[C@H](CC[NH3+])O)Br

InChI

InChI=1S/C10H14BrNO2/c11-8-1-3-10(4-2-8)14-7-9(13)5-6-12/h1-4,9,13H,5-7,12H2/p+1/t9-/m0/s1