[2,2-dimethyl-3-(2-oxidanyl-2,2-diphenyl-ethanoyl)oxy-propyl]-trimethyl-azanium iodide

Systemtic Name: [2,2-dimethyl-3-(2-oxidanyl-2,2-diphenyl-ethanoyl)oxy-propyl]-trimethyl-azanium iodide Openeye Name: [3-(2-hydroxy-2,2-diphenyl-acetyl)oxy-2,2-dimethyl-propyl]-trimethyl-ammonium iodide CAS Name: [3-(2-hydroxy-1-oxo-2,2-diphenylethoxy)-2,2-dimethylpropyl]-trimethylammonium iodide IUPAC Name: [3-(2-hydroxy-2,2-diphenylacetyl)oxy-2,2-dimethylpropyl]-trimethylazanium iodide Traditional Name: (3-benziloyloxy-2,2-dimethyl-propyl)-trimethyl-ammonium iodide Formula: C22H30INO3 MolecularWeight: 483.38297

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[N+](C)(C)C)COC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[I-]

Isomeric SMILES

CC(C)(C[N+](C)(C)C)COC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[I-]

InChI

InChI=1S/C22H30NO3.HI/c1-21(2,16-23(3,4)5)17-26-20(24)22(25,18-12-8-6-9-13-18)19-14-10-7-11-15-19;/h6-15,25H,16-17H2,1-5H3;1H/q+1;/p-1