disodium 2-(3-oxidanylidenebutanoylamino)butanedioate

Systemtic Name: disodium 2-(3-oxidanylidenebutanoylamino)butanedioate Openeye Name: disodium 2-(3-oxobutanoylamino)butanedioate CAS Name: disodium 2-(1,3-dioxobutylamino)butanedioate IUPAC Name: disodium 2-(3-oxobutanoylamino)butanedioate Traditional Name: disodium 2-(acetoacetylamino)succinate Formula: C8H9NNa2O6 MolecularWeight: 261.1397

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)NC(CC(=O)[O-])C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC(=O)CC(=O)NC(CC(=O)[O-])C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C8H11NO6.2Na/c1-4(10)2-6(11)9-5(8(14)15)3-7(12)13;;/h5H,2-3H2,1H3,(H,9,11)(H,12,13)(H,14,15);;/q;2*+1/p-2