pentasodium; azane; N-ethenylethenamine; iron(3+); pentadecaethanoate

Systemtic Name: pentasodium; azane; N-ethenylethenamine; iron(3+); pentadecaethanoate Openeye Name: pentaferric; pentasodium; ammonia; N-vinylethenamine; pentadecaacetate CAS Name: pentasodium; ammonia; N-ethenylethenamine; iron(3+); pentadecaacetate IUPAC Name: pentasodium; azane; N-ethenylethenamine; iron(3+); pentadecaacetate Traditional Name: pentaferric; pentasodium; ammonia; divinylamine; pentadecaacetate Formula: C42H84Fe5N9Na5O30+5 MolecularWeight: 1589.33251

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C4H7N.15C2H4O2.5Fe.6H3N.5Na/c3*1-3-5-4-2;15*1-2(3)4;;;;;;;;;;;;;;;;/h3*3-5H,1-2H2;15*1H3,(H,3,4);;;;;;6*1H3;;;;;/q;;;;;;;;;;;;;;;;;;5*+3;;;;;;;5*+1/p-15