[(2S)-3-[2,6-bis(bromanyl)phenoxy]-2-oxidanyl-propyl]azanium

Systemtic Name: [(2S)-3-[2,6-bis(bromanyl)phenoxy]-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-3-(2,6-dibromophenoxy)-2-hydroxy-propyl]ammonium CAS Name: [(2S)-3-(2,6-dibromophenoxy)-2-hydroxypropyl]ammonium IUPAC Name: [(2S)-3-(2,6-dibromophenoxy)-2-hydroxypropyl]azanium Traditional Name: [(2S)-3-(2,6-dibromophenoxy)-2-hydroxy-propyl]ammonium Formula: C9H12Br2NO2+ MolecularWeight: 326.00508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11Br2NO2/c10-7-2-1-3-8(11)9(7)14-5-6(13)4-12/h1-3,6,13H,4-5,12H2/p+1/t6-/m0/s1