[5-methyl-1,3-bis(oxidanyl)undecan-4-yl]azanium bromide

Systemtic Name: [5-methyl-1,3-bis(oxidanyl)undecan-4-yl]azanium bromide Openeye Name: [1-(1,3-dihydroxypropyl)-2-methyl-octyl]ammonium bromide CAS Name: (1,3-dihydroxy-5-methylundecan-4-yl)ammonium bromide IUPAC Name: (1,3-dihydroxy-5-methylundecan-4-yl)azanium bromide Traditional Name: [1-(1,3-dihydroxypropyl)-2-methyl-octyl]ammonium bromide Formula: C12H28BrNO2 MolecularWeight: 298.26022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)C(C(CCO)O)[NH3+].[Br-]

Isomeric SMILES

CCCCCCC(C)C(C(CCO)O)[NH3+].[Br-]

InChI

InChI=1S/C12H27NO2.BrH/c1-3-4-5-6-7-10(2)12(13)11(15)8-9-14;/h10-12,14-15H,3-9,13H2,1-2H3;1H