disodium 2-[[2,6-dimethyl-5-(2-oxidanidyl-2-oxidanylidene-ethoxy)carbonyl-1,4-dihydropyridin-3-yl]carbonyloxy]ethanoate

Systemtic Name: disodium 2-[[2,6-dimethyl-5-(2-oxidanidyl-2-oxidanylidene-ethoxy)carbonyl-1,4-dihydropyridin-3-yl]carbonyloxy]ethanoate Openeye Name: disodium 2-[2,6-dimethyl-5-(2-oxido-2-oxo-ethoxy)carbonyl-1,4-dihydropyridine-3-carbonyl]oxyacetate CAS Name: disodium 2-[[2,6-dimethyl-5-[(2-oxido-2-oxoethoxy)-oxomethyl]-1,4-dihydropyridin-3-yl]-oxomethoxy]acetate IUPAC Name: disodium 2-[2,6-dimethyl-5-(2-oxido-2-oxoethoxy)carbonyl-1,4-dihydropyridine-3-carbonyl]oxyacetate Traditional Name: disodium 2-[5-(2-keto-2-oxido-ethoxy)carbonyl-2,6-dimethyl-1,4-dihydropyridine-3-carbonyl]oxyacetate Formula: C13H13NNa2O8 MolecularWeight: 357.22376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(=C(N1)C)C(=O)OCC(=O)[O-])C(=O)OCC(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC1=C(CC(=C(N1)C)C(=O)OCC(=O)[O-])C(=O)OCC(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C13H15NO8.2Na/c1-6-8(12(19)21-4-10(15)16)3-9(7(2)14-6)13(20)22-5-11(17)18;;/h14H,3-5H2,1-2H3,(H,15,16)(H,17,18);;/q;2*+1/p-2