[2-(4-ethoxyphenyl)-4-oxidanyl-4-oxidanylidene-butyl]azanium chloride

Systemtic Name: [2-(4-ethoxyphenyl)-4-oxidanyl-4-oxidanylidene-butyl]azanium chloride Openeye Name: [2-(4-ethoxyphenyl)-4-hydroxy-4-oxo-butyl]ammonium chloride CAS Name: [2-(4-ethoxyphenyl)-4-hydroxy-4-oxobutyl]ammonium chloride IUPAC Name: [2-(4-ethoxyphenyl)-4-hydroxy-4-oxobutyl]azanium chloride Traditional Name: (4-hydroxy-4-keto-2-p-phenetyl-butyl)ammonium chloride Formula: C12H18ClNO3 MolecularWeight: 259.72922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(CC(=O)O)C[NH3+].[Cl-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C(CC(=O)O)C[NH3+].[Cl-]

InChI

InChI=1S/C12H17NO3.ClH/c1-2-16-11-5-3-9(4-6-11)10(8-13)7-12(14)15;/h3-6,10H,2,7-8,13H2,1H3,(H,14,15);1H