trimethyl-[2-[2-(3-oxidanylidene-3-phenyl-propyl)phenyl]carbonyloxyethyl]azanium iodide

Systemtic Name: trimethyl-[2-[2-(3-oxidanylidene-3-phenyl-propyl)phenyl]carbonyloxyethyl]azanium iodide Openeye Name: trimethyl-[2-[2-(3-oxo-3-phenyl-propyl)benzoyl]oxyethyl]ammonium iodide CAS Name: trimethyl-[2-[oxo-[2-(3-oxo-3-phenylpropyl)phenyl]methoxy]ethyl]ammonium iodide IUPAC Name: trimethyl-[2-[2-(3-oxo-3-phenylpropyl)benzoyl]oxyethyl]azanium iodide Traditional Name: 2-[2-(3-keto-3-phenyl-propyl)benzoyl]oxyethyl-trimethyl-ammonium iodide Formula: C21H26INO3 MolecularWeight: 467.34051

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOC(=O)C1=CC=CC=C1CCC(=O)C2=CC=CC=C2.[I-]

Isomeric SMILES

C[N+](C)(C)CCOC(=O)C1=CC=CC=C1CCC(=O)C2=CC=CC=C2.[I-]

InChI

InChI=1S/C21H26NO3.HI/c1-22(2,3)15-16-25-21(24)19-12-8-7-9-17(19)13-14-20(23)18-10-5-4-6-11-18;/h4-12H,13-16H2,1-3H3;1H/q+1;/p-1