carbon monoxide; iron; methyl (2Z)-2-cyclohexa-2,4-dien-1-yl-2-pyrrolidin-2-ylidene-ethanoate

Systemtic Name: carbon monoxide; iron; methyl (2Z)-2-cyclohexa-2,4-dien-1-yl-2-pyrrolidin-2-ylidene-ethanoate Openeye Name: carbon monoxide; iron; methyl (2Z)-2-cyclohexa-2,4-dien-1-yl-2-pyrrolidin-2-ylidene-acetate CAS Name: carbon monoxide; (2Z)-2-(1-cyclohexa-2,4-dienyl)-2-(2-pyrrolidinylidene)acetic acid methyl ester; iron IUPAC Name: carbon monoxide; iron; methyl (2Z)-2-cyclohexa-2,4-dien-1-yl-2-pyrrolidin-2-ylideneacetate Traditional Name: carbon monoxide; (2Z)-2-cyclohexa-2,4-dien-1-yl-2-pyrrolidin-2-ylidene-acetic acid methyl ester; iron Formula: C16H17FeNO5 MolecularWeight: 359.15488

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1CCCN1)C2CC=CC=C2.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

COC(=O)/C(=C\1/CCCN1)/C2CC=CC=C2.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C13H17NO2.3CO.Fe/c1-16-13(15)12(11-8-5-9-14-11)10-6-3-2-4-7-10;3*1-2;/h2-4,6,10,14H,5,7-9H2,1H3;;;;/b12-11-;;;;