sodium 3,4-bis(azanyl)-3,4-bis(2-oxidanidyl-2-oxidanylidene-ethyl)hexanedioate hydrate

Systemtic Name: sodium 3,4-bis(azanyl)-3,4-bis(2-oxidanidyl-2-oxidanylidene-ethyl)hexanedioate hydrate Openeye Name: sodium 3,4-diamino-3,4-bis(2-oxido-2-oxo-ethyl)hexanedioate hydrate CAS Name: sodium 3,4-diamino-3,4-bis(2-oxido-2-oxoethyl)hexanedioate hydrate IUPAC Name: sodium 3,4-diamino-3,4-bis(2-oxido-2-oxoethyl)hexanedioate hydrate Traditional Name: sodium 3,4-diamino-3,4-bis(2-keto-2-oxido-ethyl)adipate hydrate Formula: C10H14N2NaO9-3 MolecularWeight: 329.21593

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H16N2O8.Na.H2O/c11-9(1-5(13)14,2-6(15)16)10(12,3-7(17)18)4-8(19)20;;/h1-4,11-12H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);;1H2/q;+1;/p-4