iron; 2-[[(Z)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]ethanoic acid

Systemtic Name: iron; 2-[[(Z)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]ethanoic acid Openeye Name: iron; 2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]acetic acid CAS Name: iron; 2-[[(Z)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]acetic acid IUPAC Name: iron; 2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]acetic acid Traditional Name: iron; 2-[[(Z)-(6-ketocyclohexa-2,4-dien-1-ylidene)methyl]amino]acetic acid Formula: C18H18FeN2O6 MolecularWeight: 414.19032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C9H9NO3.Fe/c2*11-8-4-2-1-3-7(8)5-10-6-9(12)13;/h2*1-5,10H,6H2,(H,12,13);/b2*7-5-;