azanium; 2-[(4S)-4-azanyl-5-oxidanidyl-5-oxidanylidene-pentanoyl]oxypropanedioate; iron(2+)

Systemtic Name: azanium; 2-[(4S)-4-azanyl-5-oxidanidyl-5-oxidanylidene-pentanoyl]oxypropanedioate; iron(2+) Openeye Name: ammonium ferrous 2-[(4S)-4-amino-5-oxido-5-oxo-pentanoyl]oxypropanedioate CAS Name: ammonium; 2-[(4S)-4-amino-5-oxido-1,5-dioxopentoxy]propanedioate; iron(2+) IUPAC Name: azanium; 2-[(4S)-4-amino-5-oxido-5-oxopentanoyl]oxypropanedioate; iron(2+) Traditional Name: ammonium ferrous 2-[(4S)-4-amino-5-keto-5-oxido-pentanoyl]oxymalonate Formula: C8H12FeN2O8 MolecularWeight: 320.03448

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)OC(C(=O)[O-])C(=O)[O-])C(C(=O)[O-])N.[NH4+].[Fe+2]

Isomeric SMILES

C(CC(=O)OC(C(=O)[O-])C(=O)[O-])[C@@H](C(=O)[O-])N.[NH4+].[Fe+2]

InChI

InChI=1S/C8H11NO8.Fe.H3N/c9-3(6(11)12)1-2-4(10)17-5(7(13)14)8(15)16;;/h3,5H,1-2,9H2,(H,11,12)(H,13,14)(H,15,16);;1H3/q;+2;/p-2/t3-;;/m0../s1