2-(2-cyclohexyl-3-oxidanyl-nonanoyl)oxyethyl-diethyl-methyl-azanium bromide

Systemtic Name: 2-(2-cyclohexyl-3-oxidanyl-nonanoyl)oxyethyl-diethyl-methyl-azanium bromide Openeye Name: 2-(2-cyclohexyl-3-hydroxy-nonanoyl)oxyethyl-diethyl-methyl-ammonium bromide CAS Name: 2-(2-cyclohexyl-3-hydroxy-1-oxononoxy)ethyl-diethyl-methylammonium bromide IUPAC Name: 2-(2-cyclohexyl-3-hydroxynonanoyl)oxyethyl-diethyl-methylazanium bromide Traditional Name: 2-(2-cyclohexyl-3-hydroxy-nonanoyl)oxyethyl-diethyl-methyl-ammonium bromide Formula: C22H44BrNO3 MolecularWeight: 450.49366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C1CCCCC1)C(=O)OCC[N+](C)(CC)CC)O.[Br-]

Isomeric SMILES

CCCCCCC(C(C1CCCCC1)C(=O)OCC[N+](C)(CC)CC)O.[Br-]

InChI

InChI=1S/C22H44NO3.BrH/c1-5-8-9-13-16-20(24)21(19-14-11-10-12-15-19)22(25)26-18-17-23(4,6-2)7-3;/h19-21,24H,5-18H2,1-4H3;1H/q+1;/p-1