tetrasodium; 1,4,7-dioxazonane-5,9-dione; 2-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate

Systemtic Name: tetrasodium; 1,4,7-dioxazonane-5,9-dione; 2-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate Openeye Name: tetrasodium; 1,4,7-dioxazonane-5,9-dione; 2-[(2-oxido-2-oxo-ethyl)amino]acetate CAS Name: tetrasodium; 1,4,7-dioxazonane-5,9-dione; 2-[(2-oxido-2-oxoethyl)amino]acetate IUPAC Name: tetrasodium; 1,4,7-dioxazonane-5,9-dione; 2-[(2-oxido-2-oxoethyl)amino]acetate Traditional Name: tetrasodium; 1,4,7-dioxazonane-5,9-quinone; 2-[(2-keto-2-oxido-ethyl)amino]acetate Formula: C20H28N4Na4O16 MolecularWeight: 672.4126

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)CNCC(=O)O1.C1COC(=O)CNCC(=O)O1.C(C(=O)[O-])NCC(=O)[O-].C(C(=O)[O-])NCC(=O)[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

C1COC(=O)CNCC(=O)O1.C1COC(=O)CNCC(=O)O1.C(C(=O)[O-])NCC(=O)[O-].C(C(=O)[O-])NCC(=O)[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/2C6H9NO4.2C4H7NO4.4Na/c2*8-5-3-7-4-6(9)11-2-1-10-5;2*6-3(7)1-5-2-4(8)9;;;;/h2*7H,1-4H2;2*5H,1-2H2,(H,6,7)(H,8,9);;;;/q;;;;4*+1/p-4