12-(9-octylicosan-9-yloxy)-12-oxidanylidene-dodecanoate

Systemtic Name: 12-(9-octylicosan-9-yloxy)-12-oxidanylidene-dodecanoate Openeye Name: 12-(1,1-dioctyldodecoxy)-12-oxo-dodecanoate CAS Name: 12-(9-octyleicosan-9-yloxy)-12-oxododecanoate IUPAC Name: 12-(9-octylicosan-9-yloxy)-12-oxododecanoate Traditional Name: 12-(1,1-dioctyldodecoxy)-12-keto-laurate Formula: C40H77O4- MolecularWeight: 622.03698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CCCCCCCC)(CCCCCCCC)OC(=O)CCCCCCCCCCC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(CCCCCCCC)(CCCCCCCC)OC(=O)CCCCCCCCCCC(=O)[O-]

InChI

InChI=1S/C40H78O4/c1-4-7-10-13-16-19-22-27-32-37-40(35-30-25-14-11-8-5-2,36-31-26-15-12-9-6-3)44-39(43)34-29-24-21-18-17-20-23-28-33-38(41)42/h4-37H2,1-3H3,(H,41,42)/p-1