2-benzamidoethanoic acid; iron; tetrahydrate

Systemtic Name: 2-benzamidoethanoic acid; iron; tetrahydrate Openeye Name: 2-benzamidoacetic acid; iron; tetrahydrate CAS Name: 2-benzamidoacetic acid; iron; tetrahydrate IUPAC Name: 2-benzamidoacetic acid; iron; tetrahydrate Traditional Name: 2-benzamidoacetic acid; iron; tetrahydrate Formula: C18H26Fe2N2O10 MolecularWeight: 542.09644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCC(=O)O.C1=CC=C(C=C1)C(=O)NCC(=O)O.O.O.O.O.[Fe].[Fe]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCC(=O)O.C1=CC=C(C=C1)C(=O)NCC(=O)O.O.O.O.O.[Fe].[Fe]

InChI

InChI=1S/2C9H9NO3.2Fe.4H2O/c2*11-8(12)6-10-9(13)7-4-2-1-3-5-7;;;;;;/h2*1-5H,6H2,(H,10,13)(H,11,12);;;4*1H2