carbon monoxide; 2,6-di(cyclohexa-2,4-dien-1-yl)-4-methoxy-aniline; iron

Systemtic Name: carbon monoxide; 2,6-di(cyclohexa-2,4-dien-1-yl)-4-methoxy-aniline; iron Openeye Name: carbon monoxide; 2,6-di(cyclohexa-2,4-dien-1-yl)-4-methoxy-aniline; iron CAS Name: 2,6-bis(1-cyclohexa-2,4-dienyl)-4-methoxyaniline; carbon monoxide; iron IUPAC Name: carbon monoxide; 2,6-di(cyclohexa-2,4-dien-1-yl)-4-methoxyaniline; iron Traditional Name: carbon monoxide; [2,6-di(cyclohexa-2,4-dien-1-yl)-4-methoxy-phenyl]amine; iron Formula: C25H21Fe2NO7 MolecularWeight: 559.12674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)C2CC=CC=C2)N)C3CC=CC=C3.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe]

Isomeric SMILES

COC1=CC(=C(C(=C1)C2CC=CC=C2)N)C3CC=CC=C3.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe]

InChI

InChI=1S/C19H21NO.6CO.2Fe/c1-21-16-12-17(14-8-4-2-5-9-14)19(20)18(13-16)15-10-6-3-7-11-15;6*1-2;;/h2-8,10,12-15H,9,11,20H2,1H3;;;;;;;;