5,5-di(henpentacontoxy)-4-methyl-pentan-2-one

Systemtic Name: 5,5-di(henpentacontoxy)-4-methyl-pentan-2-one Openeye Name: 5,5-di(henpentacontoxy)-4-methyl-pentan-2-one CAS Name: 5,5-di(henpentacontoxy)-4-methyl-2-pentanone IUPAC Name: 5,5-di(henpentacontoxy)-4-methylpentan-2-one Traditional Name: 5,5-di(henpentacontoxy)-4-methyl-pentan-2-one Formula: C108H216O3 MolecularWeight: 1562.86884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCOC(C(C)CC(=O)C)OCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCOC(C(C)CC(=O)C)OCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C108H216O3/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-69-71-73-75-77-79-81-83-85-87-89-91-93-95-97-99-101-103-110-108(106(3)105-107(4)109)111-104-102-100-98-96-94-92-90-88-86-84-82-80-78-76-74-72-70-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h106,108H,5-105H2,1-4H3