carbon monoxide; ethyl 2-(4-methoxycyclohexa-2,4-dien-1-yl)ethanoate; iron

Systemtic Name: carbon monoxide; ethyl 2-(4-methoxycyclohexa-2,4-dien-1-yl)ethanoate; iron Openeye Name: carbon monoxide; ethyl 2-(4-methoxycyclohexa-2,4-dien-1-yl)acetate; iron CAS Name: carbon monoxide; iron; 2-(4-methoxy-1-cyclohexa-2,4-dienyl)acetic acid ethyl ester IUPAC Name: carbon monoxide; ethyl 2-(4-methoxycyclohexa-2,4-dien-1-yl)acetate; iron Traditional Name: carbon monoxide; iron; 2-(4-methoxycyclohexa-2,4-dien-1-yl)acetic acid ethyl ester Formula: C14H16FeO6 MolecularWeight: 336.11824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CC=C(C=C1)OC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

CCOC(=O)CC1CC=C(C=C1)OC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C11H16O3.3CO.Fe/c1-3-14-11(12)8-9-4-6-10(13-2)7-5-9;3*1-2;/h4,6-7,9H,3,5,8H2,1-2H3;;;;