4-azanyl-N-oxidanidyl-benzamide; iron(3+)

Systemtic Name: 4-azanyl-N-oxidanidyl-benzamide; iron(3+) Openeye Name: ferric 4-amino-N-oxido-benzamide CAS Name: 4-amino-N-oxidobenzamide; iron(3+) IUPAC Name: 4-amino-N-oxidobenzamide; iron(3+) Traditional Name: ferric 4-amino-N-oxido-benzamide Formula: C21H21FeN6O6 MolecularWeight: 509.27304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N[O-])N.C1=CC(=CC=C1C(=O)N[O-])N.C1=CC(=CC=C1C(=O)N[O-])N.[Fe+3]

Isomeric SMILES

C1=CC(=CC=C1C(=O)N[O-])N.C1=CC(=CC=C1C(=O)N[O-])N.C1=CC(=CC=C1C(=O)N[O-])N.[Fe+3]

InChI

InChI=1S/3C7H7N2O2.Fe/c3*8-6-3-1-5(2-4-6)7(10)9-11;/h3*1-4H,(H3-,8,9,10,11);/q3*-1;+3