(2S)-3-(1,4,7-triazonane-4,7-diium-1-yl)propane-1,2-diol dibromide

Systemtic Name: (2S)-3-(1,4,7-triazonane-4,7-diium-1-yl)propane-1,2-diol dibromide Openeye Name: (2S)-3-(1,4,7-triazonane-4,7-diium-1-yl)propane-1,2-diol dibromide CAS Name: (2S)-3-(1,4,7-triazonane-4,7-diium-1-yl)propane-1,2-diol dibromide IUPAC Name: (2S)-3-(1,4,7-triazonane-4,7-diium-1-yl)propane-1,2-diol dibromide Traditional Name: (2S)-3-(1,4,7-triazonane-4,7-diium-1-yl)propane-1,2-diol dibromide Formula: C9H23Br2N3O2 MolecularWeight: 365.10582

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(CC[NH2+]1)CC(CO)O.[Br-].[Br-]

Isomeric SMILES

C1C[NH2+]CCN(CC[NH2+]1)C[C@@H](CO)O.[Br-].[Br-]

InChI

InChI=1S/C9H21N3O2.2BrH/c13-8-9(14)7-12-5-3-10-1-2-11-4-6-12;;/h9-11,13-14H,1-8H2;2*1H/t9-;;/m0../s1