[1-methoxy-1,3-bis(oxidanylidene)-7-phenylmethoxy-heptan-2-yl]azanium chloride

Systemtic Name: [1-methoxy-1,3-bis(oxidanylidene)-7-phenylmethoxy-heptan-2-yl]azanium chloride Openeye Name: (6-benzyloxy-1-methoxycarbonyl-2-oxo-hexyl)ammonium chloride CAS Name: (1-methoxy-1,3-dioxo-7-phenylmethoxyheptan-2-yl)ammonium chloride IUPAC Name: (1-methoxy-1,3-dioxo-7-phenylmethoxyheptan-2-yl)azanium chloride Traditional Name: (6-benzoxy-1-carbomethoxy-2-keto-hexyl)ammonium chloride Formula: C15H22ClNO4 MolecularWeight: 315.79248

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(=O)CCCCOCC1=CC=CC=C1)[NH3+].[Cl-]

Isomeric SMILES

COC(=O)C(C(=O)CCCCOCC1=CC=CC=C1)[NH3+].[Cl-]

InChI

InChI=1S/C15H21NO4.ClH/c1-19-15(18)14(16)13(17)9-5-6-10-20-11-12-7-3-2-4-8-12;/h2-4,7-8,14H,5-6,9-11,16H2,1H3;1H