sodium; (2S)-2-[bis(2-oxidanidyl-2-oxidanylidene-ethyl)amino]pentanedioate; iron(3+)

Systemtic Name: sodium; (2S)-2-[bis(2-oxidanidyl-2-oxidanylidene-ethyl)amino]pentanedioate; iron(3+) Openeye Name: ferric sodium (2S)-2-[bis(2-oxido-2-oxo-ethyl)amino]pentanedioate CAS Name: sodium; (2S)-2-[bis(2-oxido-2-oxoethyl)amino]pentanedioate; iron(3+) IUPAC Name: sodium; (2S)-2-[bis(2-oxido-2-oxoethyl)amino]pentanedioate; iron(3+) Traditional Name: ferric sodium (2S)-2-[bis(2-keto-2-oxido-ethyl)amino]glutarate Formula: C9H9FeNNaO8 MolecularWeight: 338.00443

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)[O-])C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Fe+3]

Isomeric SMILES

C(CC(=O)[O-])[C@@H](C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Fe+3]

InChI

InChI=1S/C9H13NO8.Fe.Na/c11-6(12)2-1-5(9(17)18)10(3-7(13)14)4-8(15)16;;/h5H,1-4H2,(H,11,12)(H,13,14)(H,15,16)(H,17,18);;/q;+3;+1/p-4/t5-;;/m0../s1