[(2S)-3-(4-hydroxyphenyl)-1-(2-methoxyethoxy)-1-oxidanylidene-propan-2-yl]azanium chloride

Systemtic Name: [(2S)-3-(4-hydroxyphenyl)-1-(2-methoxyethoxy)-1-oxidanylidene-propan-2-yl]azanium chloride Openeye Name: [(1S)-1-[(4-hydroxyphenyl)methyl]-2-(2-methoxyethoxy)-2-oxo-ethyl]ammonium chloride CAS Name: [(2S)-3-(4-hydroxyphenyl)-1-(2-methoxyethoxy)-1-oxopropan-2-yl]ammonium chloride IUPAC Name: [(2S)-3-(4-hydroxyphenyl)-1-(2-methoxyethoxy)-1-oxopropan-2-yl]azanium chloride Traditional Name: [(1S)-1-(4-hydroxybenzyl)-2-keto-2-(2-methoxyethoxy)ethyl]ammonium chloride Formula: C12H18ClNO4 MolecularWeight: 275.72862

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C(CC1=CC=C(C=C1)O)[NH3+].[Cl-]

Isomeric SMILES

COCCOC(=O)[C@H](CC1=CC=C(C=C1)O)[NH3+].[Cl-]

InChI

InChI=1S/C12H17NO4.ClH/c1-16-6-7-17-12(15)11(13)8-9-2-4-10(14)5-3-9;/h2-5,11,14H,6-8,13H2,1H3;1H/t11-;/m0./s1