carbon monoxide; cobalt; (9S)-7-methyl-9-phenylmethoxy-heptadec-5-yn-7-ol

Systemtic Name: carbon monoxide; cobalt; (9S)-7-methyl-9-phenylmethoxy-heptadec-5-yn-7-ol Openeye Name: (9S)-9-benzyloxy-7-methyl-heptadec-5-yn-7-ol; carbon monoxide; cobalt CAS Name: carbon monoxide; cobalt; (9S)-7-methyl-9-phenylmethoxy-5-heptadecyn-7-ol IUPAC Name: carbon monoxide; cobalt; (9S)-7-methyl-9-phenylmethoxyheptadec-5-yn-7-ol Traditional Name: (9S)-9-benzoxy-7-methyl-heptadec-5-yn-7-ol; carbon monoxide; cobalt Formula: C33H40Co2O10 MolecularWeight: 714.5311

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CC(C)(C#CCCCC)O)OCC1=CC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Co]

Isomeric SMILES

CCCCCCCC[C@@H](CC(C)(C#CCCCC)O)OCC1=CC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Co]

InChI

InChI=1S/C25H40O2.8CO.2Co/c1-4-6-8-10-11-15-19-24(27-22-23-17-13-12-14-18-23)21-25(3,26)20-16-9-7-5-2;8*1-2;;/h12-14,17-18,24,26H,4-11,15,19,21-22H2,1-3H3;;;;;;;;;;/t24-,25?;;;;;;;;;;/m0........../s1