16-methylheptadecyl 2-hexadecyl-18-methyl-3-oxidanylidene-nonadecanoate

Systemtic Name: 16-methylheptadecyl 2-hexadecyl-18-methyl-3-oxidanylidene-nonadecanoate Openeye Name: 16-methylheptadecyl 2-hexadecyl-18-methyl-3-oxo-nonadecanoate CAS Name: 2-hexadecyl-18-methyl-3-oxononadecanoic acid 16-methylheptadecyl ester IUPAC Name: 16-methylheptadecyl 2-hexadecyl-18-methyl-3-oxononadecanoate Traditional Name: 2-cetyl-3-keto-18-methyl-nonadecanoic acid 16-methylheptadecyl ester Formula: C54H106O3 MolecularWeight: 803.41764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(=O)CCCCCCCCCCCCCCC(C)C)C(=O)OCCCCCCCCCCCCCCCC(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(=O)CCCCCCCCCCCCCCC(C)C)C(=O)OCCCCCCCCCCCCCCCC(C)C

InChI

InChI=1S/C54H106O3/c1-6-7-8-9-10-11-12-13-16-22-27-32-37-42-47-52(53(55)48-43-38-33-28-23-18-17-21-26-31-36-41-46-51(4)5)54(56)57-49-44-39-34-29-24-19-14-15-20-25-30-35-40-45-50(2)3/h50-52H,6-49H2,1-5H3