carbon monoxide; iron; 4-methoxy-N-[2-(4-methoxycyclohexa-2,4-dien-1-yl)ethyl]aniline

Systemtic Name: carbon monoxide; iron; 4-methoxy-N-[2-(4-methoxycyclohexa-2,4-dien-1-yl)ethyl]aniline Openeye Name: carbon monoxide; iron; 4-methoxy-N-[2-(4-methoxycyclohexa-2,4-dien-1-yl)ethyl]aniline CAS Name: carbon monoxide; iron; 4-methoxy-N-[2-(4-methoxy-1-cyclohexa-2,4-dienyl)ethyl]aniline IUPAC Name: carbon monoxide; iron; 4-methoxy-N-[2-(4-methoxycyclohexa-2,4-dien-1-yl)ethyl]aniline Traditional Name: carbon monoxide; iron; 2-(4-methoxycyclohexa-2,4-dien-1-yl)ethyl-(4-methoxyphenyl)amine Formula: C19H21FeNO5 MolecularWeight: 399.21874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CCC(C=C1)CCNC2=CC=C(C=C2)OC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

COC1=CCC(C=C1)CCNC2=CC=C(C=C2)OC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C16H21NO2.3CO.Fe/c1-18-15-7-3-13(4-8-15)11-12-17-14-5-9-16(19-2)10-6-14;3*1-2;/h3,5-10,13,17H,4,11-12H2,1-2H3;;;;