trimethyl-(2-oxidanyl-3-oxidanylidene-3-phenyl-propyl)azanium iodide

Systemtic Name: trimethyl-(2-oxidanyl-3-oxidanylidene-3-phenyl-propyl)azanium iodide Openeye Name: (2-hydroxy-3-oxo-3-phenyl-propyl)-trimethyl-ammonium iodide CAS Name: (2-hydroxy-3-oxo-3-phenylpropyl)-trimethylammonium iodide IUPAC Name: (2-hydroxy-3-oxo-3-phenylpropyl)-trimethylazanium iodide Traditional Name: (2-hydroxy-3-keto-3-phenyl-propyl)-trimethyl-ammonium iodide Formula: C12H18INO2 MolecularWeight: 335.18129

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18NO2.HI/c1-13(2,3)9-11(14)12(15)10-7-5-4-6-8-10;/h4-8,11,14H,9H2,1-3H3;1H/q+1;/p-1