carbon monoxide; iron; (5-methoxycyclohexa-1,3-dien-1-yl)sulfonylbenzene

Systemtic Name: carbon monoxide; iron; (5-methoxycyclohexa-1,3-dien-1-yl)sulfonylbenzene Openeye Name: carbon monoxide; iron; (5-methoxycyclohexa-1,3-dien-1-yl)sulfonylbenzene CAS Name: carbon monoxide; iron; (5-methoxy-1-cyclohexa-1,3-dienyl)sulfonylbenzene IUPAC Name: carbon monoxide; iron; (5-methoxycyclohexa-1,3-dien-1-yl)sulfonylbenzene Traditional Name: carbon monoxide; iron; (5-methoxycyclohexa-1,3-dien-1-yl)sulfonylbenzene Formula: C16H14FeO6S MolecularWeight: 390.18876

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(=CC=C1)S(=O)(=O)C2=CC=CC=C2.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

COC1CC(=CC=C1)S(=O)(=O)C2=CC=CC=C2.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C13H14O3S.3CO.Fe/c1-16-11-6-5-9-13(10-11)17(14,15)12-7-3-2-4-8-12;3*1-2;/h2-9,11H,10H2,1H3;;;;