azanium; iron(3+); 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: azanium; iron(3+); 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: ammonium ferric tricitrate CAS Name: ammonium; 2-hydroxypropane-1,2,3-tricarboxylate; iron(3+) IUPAC Name: azanium; 2-hydroxypropane-1,2,3-tricarboxylate; iron(3+) Traditional Name: ammonium ferric tricitrate Formula: C18H19FeNO21-5 MolecularWeight: 641.18256

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[NH4+].[Fe+3]

Isomeric SMILES

C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[NH4+].[Fe+3]

InChI

InChI=1S/3C6H8O7.Fe.H3N/c3*7-3(8)1-6(13,5(11)12)2-4(9)10;;/h3*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;1H3/q;;;+3;/p-8