(6-ethoxy-6-oxidanylidene-hexyl)-(4-propylheptadecan-4-yl)azanium bromide

Systemtic Name: (6-ethoxy-6-oxidanylidene-hexyl)-(4-propylheptadecan-4-yl)azanium bromide Openeye Name: 1,1-dipropyltetradecyl-(6-ethoxy-6-oxo-hexyl)ammonium bromide CAS Name: (6-ethoxy-6-oxohexyl)-(4-propylheptadecan-4-yl)ammonium bromide IUPAC Name: (6-ethoxy-6-oxohexyl)-(4-propylheptadecan-4-yl)azanium bromide Traditional Name: 1,1-dipropyltetradecyl-(6-ethoxy-6-keto-hexyl)ammonium bromide Formula: C28H58BrNO2 MolecularWeight: 520.66962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CCC)(CCC)[NH2+]CCCCCC(=O)OCC.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCC(CCC)(CCC)[NH2+]CCCCCC(=O)OCC.[Br-]

InChI

InChI=1S/C28H57NO2.BrH/c1-5-9-10-11-12-13-14-15-16-17-20-25-28(23-6-2,24-7-3)29-26-21-18-19-22-27(30)31-8-4;/h29H,5-26H2,1-4H3;1H