carbon monoxide; iron; (3R,6E,8E)-1-(3-methoxy-4-phenylmethoxy-phenyl)-3-oxidanyl-deca-6,8-dien-5-one

Systemtic Name: carbon monoxide; iron; (3R,6E,8E)-1-(3-methoxy-4-phenylmethoxy-phenyl)-3-oxidanyl-deca-6,8-dien-5-one Openeye Name: (3R,6E,8E)-1-(4-benzyloxy-3-methoxy-phenyl)-3-hydroxy-deca-6,8-dien-5-one; carbon monoxide; iron CAS Name: carbon monoxide; (3R,6E,8E)-3-hydroxy-1-(3-methoxy-4-phenylmethoxyphenyl)-5-deca-6,8-dienone; iron IUPAC Name: carbon monoxide; (3R,6E,8E)-3-hydroxy-1-(3-methoxy-4-phenylmethoxyphenyl)deca-6,8-dien-5-one; iron Traditional Name: (3R,6E,8E)-1-(4-benzoxy-3-methoxy-phenyl)-3-hydroxy-deca-6,8-dien-5-one; carbon monoxide; iron Formula: C27H28FeO7 MolecularWeight: 520.35202

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)CC(CCC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

C/C=C/C=C/C(=O)C[C@@H](CCC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C24H28O4.3CO.Fe/c1-3-4-6-11-21(25)17-22(26)14-12-19-13-15-23(24(16-19)27-2)28-18-20-9-7-5-8-10-20;3*1-2;/h3-11,13,15-16,22,26H,12,14,17-18H2,1-2H3;;;;/b4-3+,11-6+;;;;/t22-;;;;/m1..../s1