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

Systemtic Name: [(2S)-3-(2-bromanylphenoxy)-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-3-(2-bromophenoxy)-2-hydroxy-propyl]ammonium CAS Name: [(2S)-3-(2-bromophenoxy)-2-hydroxypropyl]ammonium IUPAC Name: [(2S)-3-(2-bromophenoxy)-2-hydroxypropyl]azanium Traditional Name: [(2S)-3-(2-bromophenoxy)-2-hydroxy-propyl]ammonium Formula: C9H13BrNO2+ MolecularWeight: 247.10902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCC(C[NH3+])O)Br

Isomeric SMILES

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

InChI

InChI=1S/C9H12BrNO2/c10-8-3-1-2-4-9(8)13-6-7(12)5-11/h1-4,7,12H,5-6,11H2/p+1/t7-/m0/s1