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

Systemtic Name: trimethyl-(2-oxidanyl-3-oxidanylidene-3-phenyl-propyl)azanium chloride Openeye Name: (2-hydroxy-3-oxo-3-phenyl-propyl)-trimethyl-ammonium chloride CAS Name: (2-hydroxy-3-oxo-3-phenylpropyl)-trimethylammonium chloride IUPAC Name: (2-hydroxy-3-oxo-3-phenylpropyl)-trimethylazanium chloride Traditional Name: (2-hydroxy-3-keto-3-phenyl-propyl)-trimethyl-ammonium chloride Formula: C12H18ClNO2 MolecularWeight: 243.72982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18NO2.ClH/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