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

Systemtic Name: hexyl-dimethyl-[2-(2-oxidanyl-2,2-diphenyl-ethanoyl)oxyethyl]azanium bromide Openeye Name: hexyl-[2-(2-hydroxy-2,2-diphenyl-acetyl)oxyethyl]-dimethyl-ammonium bromide CAS Name: hexyl-[2-(2-hydroxy-1-oxo-2,2-diphenylethoxy)ethyl]-dimethylammonium bromide IUPAC Name: hexyl-[2-(2-hydroxy-2,2-diphenylacetyl)oxyethyl]-dimethylazanium bromide Traditional Name: 2-benziloyloxyethyl-hexyl-dimethyl-ammonium bromide Formula: C24H34BrNO3 MolecularWeight: 464.43566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H34NO3.BrH/c1-4-5-6-13-18-25(2,3)19-20-28-23(26)24(27,21-14-9-7-10-15-21)22-16-11-8-12-17-22;/h7-12,14-17,27H,4-6,13,18-20H2,1-3H3;1H/q+1;/p-1