triazanium; (Z)-but-2-enedioate; (E)-but-2-enedioate; iron(3+)

Systemtic Name: triazanium; (Z)-but-2-enedioate; (E)-but-2-enedioate; iron(3+) Openeye Name: triammonium; ferric; (Z)-but-2-enedioate; (E)-but-2-enedioate CAS Name: triammonium; (Z)-2-butenedioate; (E)-2-butenedioate; iron(3+) IUPAC Name: triazanium; (Z)-but-2-enedioate; (E)-but-2-enedioate; iron(3+) Traditional Name: triammonium ferric difumarate maleate Formula: C12H18FeN3O12 MolecularWeight: 452.12922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C4H4O4.Fe.3H3N/c3*5-3(6)1-2-4(7)8;;;;/h3*1-2H,(H,5,6)(H,7,8);;3*1H3/q;;;+3;;;/p-3/b2*2-1+;2-1-;;;;