carbon monoxide; S-ethyl (2Z)-3,4-dimethylpenta-2,4-dienethioate; iron

Systemtic Name: carbon monoxide; S-ethyl (2Z)-3,4-dimethylpenta-2,4-dienethioate; iron Openeye Name: carbon monoxide; S-ethyl (2Z)-3,4-dimethylpenta-2,4-dienethioate; iron CAS Name: carbon monoxide; (2Z)-3,4-dimethylpenta-2,4-dienethioic acid S-ethyl ester; iron IUPAC Name: carbon monoxide; S-ethyl (2Z)-3,4-dimethylpenta-2,4-dienethioate; iron Traditional Name: carbon monoxide; (2Z)-3,4-dimethylpenta-2,4-dienethioic acid S-ethyl ester; iron Formula: C12H14FeO4S MolecularWeight: 310.14716

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C=C(C)C(=C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

CCSC(=O)/C=C(/C)\C(=C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C9H14OS.3CO.Fe/c1-5-11-9(10)6-8(4)7(2)3;3*1-2;/h6H,2,5H2,1,3-4H3;;;;/b8-6-;;;;