iron(3+); 5-oxidanidyliminocyclohepta-3,6-diene-1,2-dione

Systemtic Name: iron(3+); 5-oxidanidyliminocyclohepta-3,6-diene-1,2-dione Openeye Name: ferric 5-oxidoiminocyclohepta-3,6-diene-1,2-dione CAS Name: iron(3+); 5-oxidoiminocyclohepta-3,6-diene-1,2-dione IUPAC Name: iron(3+); 5-oxidoiminocyclohepta-3,6-diene-1,2-dione Traditional Name: ferric 5-oxidoiminocyclohepta-3,6-diene-1,2-quinone Formula: C21H12FeN3O9 MolecularWeight: 506.17968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=O)C=CC1=N[O-].C1=CC(=O)C(=O)C=CC1=N[O-].C1=CC(=O)C(=O)C=CC1=N[O-].[Fe+3]

Isomeric SMILES

C1=CC(=O)C(=O)C=CC1=N[O-].C1=CC(=O)C(=O)C=CC1=N[O-].C1=CC(=O)C(=O)C=CC1=N[O-].[Fe+3]

InChI

InChI=1S/3C7H5NO3.Fe/c3*9-6-3-1-5(8-11)2-4-7(6)10;/h3*1-4,11H;/q;;;+3/p-3