[1,5-dimethoxy-1,5-bis(oxidanylidene)-3-phenyl-pentan-2-yl]azanium chloride

Systemtic Name: [1,5-dimethoxy-1,5-bis(oxidanylidene)-3-phenyl-pentan-2-yl]azanium chloride Openeye Name: (4-methoxy-1-methoxycarbonyl-4-oxo-2-phenyl-butyl)ammonium chloride CAS Name: (1,5-dimethoxy-1,5-dioxo-3-phenylpentan-2-yl)ammonium chloride IUPAC Name: (1,5-dimethoxy-1,5-dioxo-3-phenylpentan-2-yl)azanium chloride Traditional Name: (1-carbomethoxy-4-keto-4-methoxy-2-phenyl-butyl)ammonium chloride Formula: C13H18ClNO4 MolecularWeight: 287.73932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO4.ClH/c1-17-11(15)8-10(12(14)13(16)18-2)9-6-4-3-5-7-9;/h3-7,10,12H,8,14H2,1-2H3;1H