2-acetyloxyethyl(henicosan-11-yl)azanium bromide

Systemtic Name: 2-acetyloxyethyl(henicosan-11-yl)azanium bromide Openeye Name: 2-acetoxyethyl(1-decylundecyl)ammonium bromide CAS Name: 2-acetyloxyethyl(heneicosan-11-yl)ammonium bromide IUPAC Name: 2-acetyloxyethyl(henicosan-11-yl)azanium bromide Traditional Name: 2-acetoxyethyl(1-decylundecyl)ammonium bromide Formula: C25H52BrNO2 MolecularWeight: 478.58988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCCCCCCCC)[NH2+]CCOC(=O)C.[Br-]

Isomeric SMILES

CCCCCCCCCCC(CCCCCCCCCC)[NH2+]CCOC(=O)C.[Br-]

InChI

InChI=1S/C25H51NO2.BrH/c1-4-6-8-10-12-14-16-18-20-25(26-22-23-28-24(3)27)21-19-17-15-13-11-9-7-5-2;/h25-26H,4-23H2,1-3H3;1H