2-[[4-(C-azanidylcarbonimidoyl)-2-oxidanidyl-phenyl]methylideneamino]propanoate; iron(3+)

Systemtic Name: 2-[[4-(C-azanidylcarbonimidoyl)-2-oxidanidyl-phenyl]methylideneamino]propanoate; iron(3+) Openeye Name: ferric 2-[[4-(azanidylcarbonimidoyl)-2-oxido-phenyl]methyleneamino]propanoate CAS Name: 2-[[4-[azanidyl(imino)methyl]-2-oxidophenyl]methylideneamino]propanoate; iron(3+) IUPAC Name: 2-[[4-(C-azanidylcarbonimidoyl)-2-oxidophenyl]methylideneamino]propanoate; iron(3+) Traditional Name: ferric 2-[[4-(amidylcarbonimidoyl)-2-oxido-benzylidene]amino]propionate Formula: C11H10FeN3O3 MolecularWeight: 288.0604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O3.Fe/c1-6(11(16)17)14-5-8-3-2-7(10(12)13)4-9(8)15;/h2-6H,1H3,(H5,12,13,14,15,16,17);/q;+3/p-3