[1,4-diethoxy-1,4-bis(oxidanylidene)-3-phenyl-butan-2-yl]azanium chloride

Systemtic Name: [1,4-diethoxy-1,4-bis(oxidanylidene)-3-phenyl-butan-2-yl]azanium chloride Openeye Name: (3-ethoxy-1-ethoxycarbonyl-3-oxo-2-phenyl-propyl)ammonium chloride CAS Name: (1,4-diethoxy-1,4-dioxo-3-phenylbutan-2-yl)ammonium chloride IUPAC Name: (1,4-diethoxy-1,4-dioxo-3-phenylbutan-2-yl)azanium chloride Traditional Name: (1-carbethoxy-3-ethoxy-3-keto-2-phenyl-propyl)ammonium chloride Formula: C14H20ClNO4 MolecularWeight: 301.7659

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO4.ClH/c1-3-18-13(16)11(10-8-6-5-7-9-10)12(15)14(17)19-4-2;/h5-9,11-12H,3-4,15H2,1-2H3;1H