2-(4-ethanoyl-3-oxidanyl-phenoxy)ethyl-dimethyl-azanium chloride

Systemtic Name: 2-(4-ethanoyl-3-oxidanyl-phenoxy)ethyl-dimethyl-azanium chloride Openeye Name: 2-(4-acetyl-3-hydroxy-phenoxy)ethyl-dimethyl-ammonium chloride CAS Name: 2-(4-acetyl-3-hydroxyphenoxy)ethyl-dimethylammonium chloride IUPAC Name: 2-(4-acetyl-3-hydroxyphenoxy)ethyl-dimethylazanium chloride Traditional Name: 2-(4-acetyl-3-hydroxy-phenoxy)ethyl-dimethyl-ammonium chloride Formula: C12H18ClNO3 MolecularWeight: 259.72922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO3.ClH/c1-9(14)11-5-4-10(8-12(11)15)16-7-6-13(2)3;/h4-5,8,15H,6-7H2,1-3H3;1H