[3-(3-chloranylpropyl)-2-methyl-nonan-2-yl]azanium bromide

Systemtic Name: [3-(3-chloranylpropyl)-2-methyl-nonan-2-yl]azanium bromide Openeye Name: [2-(3-chloropropyl)-1,1-dimethyl-octyl]ammonium bromide CAS Name: [3-(3-chloropropyl)-2-methylnonan-2-yl]ammonium bromide IUPAC Name: [3-(3-chloropropyl)-2-methylnonan-2-yl]azanium bromide Traditional Name: [2-(3-chloropropyl)-1,1-dimethyl-octyl]ammonium bromide Formula: C13H29BrClN MolecularWeight: 314.73306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCl)C(C)(C)[NH3+].[Br-]

Isomeric SMILES

CCCCCCC(CCCCl)C(C)(C)[NH3+].[Br-]

InChI

InChI=1S/C13H28ClN.BrH/c1-4-5-6-7-9-12(10-8-11-14)13(2,3)15;/h12H,4-11,15H2,1-3H3;1H