dodecyl-dimethyl-[2-(2-oxidanyl-2,2-diphenyl-ethanoyl)oxyethyl]azanium bromide

Systemtic Name: dodecyl-dimethyl-[2-(2-oxidanyl-2,2-diphenyl-ethanoyl)oxyethyl]azanium bromide Openeye Name: dodecyl-[2-(2-hydroxy-2,2-diphenyl-acetyl)oxyethyl]-dimethyl-ammonium bromide CAS Name: dodecyl-[2-(2-hydroxy-1-oxo-2,2-diphenylethoxy)ethyl]-dimethylammonium bromide IUPAC Name: dodecyl-[2-(2-hydroxy-2,2-diphenylacetyl)oxyethyl]-dimethylazanium bromide Traditional Name: 2-benziloyloxyethyl-lauryl-dimethyl-ammonium bromide Formula: C30H46BrNO3 MolecularWeight: 548.59514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[Br-]

Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[Br-]

InChI

InChI=1S/C30H46NO3.BrH/c1-4-5-6-7-8-9-10-11-12-19-24-31(2,3)25-26-34-29(32)30(33,27-20-15-13-16-21-27)28-22-17-14-18-23-28;/h13-18,20-23,33H,4-12,19,24-26H2,1-3H3;1H/q+1;/p-1