magnesium (5-methoxy-5-oxidanylidene-pentan-2-yl)-bis(oxidanidyl)-(phenylmethyl)azanium chloride

Systemtic Name: magnesium (5-methoxy-5-oxidanylidene-pentan-2-yl)-bis(oxidanidyl)-(phenylmethyl)azanium chloride Openeye Name: magnesium benzyl-(4-methoxy-1-methyl-4-oxo-butyl)-dioxido-ammonium chloride CAS Name: magnesium (5-methoxy-5-oxopentan-2-yl)-dioxido-(phenylmethyl)ammonium chloride IUPAC Name: magnesium benzyl-(5-methoxy-5-oxopentan-2-yl)-dioxidoazanium chloride Traditional Name: magnesium benzyl-(4-keto-4-methoxy-1-methyl-butyl)-dioxido-ammonium chloride Formula: C13H18ClMgNO4 MolecularWeight: 312.04432

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)OC)[N+](CC1=CC=CC=C1)([O-])[O-].[Mg+2].[Cl-]

Isomeric SMILES

CC(CCC(=O)OC)[N+](CC1=CC=CC=C1)([O-])[O-].[Mg+2].[Cl-]

InChI

InChI=1S/C13H18NO4.ClH.Mg/c1-11(8-9-13(15)18-2)14(16,17)10-12-6-4-3-5-7-12;;/h3-7,11H,8-10H2,1-2H3;1H;/q-1;;+2/p-1