[3-nonanoyloxy-2,2-bis(nonanoyloxymethyl)propyl] nonanoate

Systemtic Name: [3-nonanoyloxy-2,2-bis(nonanoyloxymethyl)propyl] nonanoate Openeye Name: [3-nonanoyloxy-2,2-bis(nonanoyloxymethyl)propyl] nonanoate CAS Name: nonanoic acid [3-(1-oxononoxy)-2,2-bis(1-oxononoxymethyl)propyl] ester IUPAC Name: [3-nonanoyloxy-2,2-bis(nonanoyloxymethyl)propyl] nonanoate Traditional Name: pelargonic acid [3-pelargonyloxy-2,2-bis(pelargonyloxymethyl)propyl] ester Formula: C41H76O8 MolecularWeight: 697.03734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC)(COC(=O)CCCCCCCC)COC(=O)CCCCCCCC

Isomeric SMILES

CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC)(COC(=O)CCCCCCCC)COC(=O)CCCCCCCC

InChI

InChI=1S/C41H76O8/c1-5-9-13-17-21-25-29-37(42)46-33-41(34-47-38(43)30-26-22-18-14-10-6-2,35-48-39(44)31-27-23-19-15-11-7-3)36-49-40(45)32-28-24-20-16-12-8-4/h5-36H2,1-4H3