carbon monoxide; iron; [2-[(2E,4E)-nona-2,4-dienoxy]-3-phenylmethoxy-propyl] benzoate

Systemtic Name: carbon monoxide; iron; [2-[(2E,4E)-nona-2,4-dienoxy]-3-phenylmethoxy-propyl] benzoate Openeye Name: [3-benzyloxy-2-[(2E,4E)-nona-2,4-dienoxy]propyl] benzoate; carbon monoxide; iron CAS Name: benzoic acid [2-[(2E,4E)-nona-2,4-dienoxy]-3-phenylmethoxypropyl] ester; carbon monoxide; iron IUPAC Name: carbon monoxide; iron; [2-[(2E,4E)-nona-2,4-dienoxy]-3-phenylmethoxypropyl] benzoate Traditional Name: benzoic acid [3-benzoxy-2-[(2E,4E)-nona-2,4-dienoxy]propyl] ester; carbon monoxide; iron Formula: C29H32FeO7 MolecularWeight: 548.40518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC=CCOC(COCC1=CC=CC=C1)COC(=O)C2=CC=CC=C2.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

CCCC/C=C/C=C/COC(COCC1=CC=CC=C1)COC(=O)C2=CC=CC=C2.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C26H32O4.3CO.Fe/c1-2-3-4-5-6-7-14-19-29-25(21-28-20-23-15-10-8-11-16-23)22-30-26(27)24-17-12-9-13-18-24;3*1-2;/h5-18,25H,2-4,19-22H2,1H3;;;;/b6-5+,14-7+;;;;