carbon monoxide; (Z)-4-cyclohexa-2,4-dien-1-yl-2-diazonio-1-methoxy-3-oxidanylidene-but-1-en-1-olate; iron

Systemtic Name: carbon monoxide; (Z)-4-cyclohexa-2,4-dien-1-yl-2-diazonio-1-methoxy-3-oxidanylidene-but-1-en-1-olate; iron Openeye Name: carbon monoxide; (Z)-4-cyclohexa-2,4-dien-1-yl-2-diazonio-1-methoxy-3-oxo-but-1-en-1-olate; iron CAS Name: carbon monoxide; (Z)-4-(1-cyclohexa-2,4-dienyl)-2-diazonio-1-methoxy-3-oxo-1-buten-1-olate; iron IUPAC Name: carbon monoxide; (Z)-4-cyclohexa-2,4-dien-1-yl-2-diazonio-1-methoxy-3-oxobut-1-en-1-olate; iron Traditional Name: carbon monoxide; (Z)-4-cyclohexa-2,4-dien-1-yl-2-diazonio-3-keto-1-methoxy-but-1-en-1-olate; iron Formula: C14H12FeN2O6 MolecularWeight: 360.09988

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C(C(=O)CC1CC=CC=C1)[N+]#N)[O-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

CO/C(=C(/C(=O)CC1CC=CC=C1)\[N+]#N)/[O-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C11H12N2O3.3CO.Fe/c1-16-11(15)10(13-12)9(14)7-8-5-3-2-4-6-8;3*1-2;/h2-5,8H,6-7H2,1H3;;;;