carbon monoxide; cobalt; 7-phenylmethoxyhepta-2,5-diynoxymethylbenzene

Systemtic Name: carbon monoxide; cobalt; 7-phenylmethoxyhepta-2,5-diynoxymethylbenzene Openeye Name: 7-benzyloxyhepta-2,5-diynoxymethylbenzene; carbon monoxide; cobalt CAS Name: carbon monoxide; cobalt; 7-phenylmethoxyhepta-2,5-diynoxymethylbenzene IUPAC Name: carbon monoxide; cobalt; 7-phenylmethoxyhepta-2,5-diynoxymethylbenzene Traditional Name: 7-benzoxyhepta-2,5-diynoxymethylbenzene; carbon monoxide; cobalt Formula: C33H20Co4O14 MolecularWeight: 876.2363

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)COCC#CCC#CCOCC2=CC=CC=C2.[Co].[Co].[Co].[Co]

Isomeric SMILES

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)COCC#CCC#CCOCC2=CC=CC=C2.[Co].[Co].[Co].[Co]

InChI

InChI=1S/C21H20O2.12CO.4Co/c1(2-10-16-22-18-20-12-6-4-7-13-20)3-11-17-23-19-21-14-8-5-9-15-21;12*1-2;;;;/h4-9,12-15H,1,16-19H2;;;;;;;;;;;;;;;;