2-heptyldodecyl(2-propanoyloxyethyl)azanium bromide

Systemtic Name: 2-heptyldodecyl(2-propanoyloxyethyl)azanium bromide Openeye Name: 2-heptyldodecyl(2-propanoyloxyethyl)ammonium bromide CAS Name: 2-heptyldodecyl-[2-(1-oxopropoxy)ethyl]ammonium bromide IUPAC Name: 2-heptyldodecyl(2-propanoyloxyethyl)azanium bromide Traditional Name: 2-heptyldodecyl(2-propionyloxyethyl)ammonium bromide Formula: C24H50BrNO2 MolecularWeight: 464.5633

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H49NO2.BrH/c1-4-7-9-11-12-13-15-17-19-23(18-16-14-10-8-5-2)22-25-20-21-27-24(26)6-3;/h23,25H,4-22H2,1-3H3;1H