hexadecan-7-yl 2-decyl-3-hexyl-3-oxidanyl-dodecanoate

Systemtic Name: hexadecan-7-yl 2-decyl-3-hexyl-3-oxidanyl-dodecanoate Openeye Name: 1-hexyldecyl 2-decyl-3-hexyl-3-hydroxy-dodecanoate CAS Name: 2-decyl-3-hexyl-3-hydroxydodecanoic acid hexadecan-7-yl ester IUPAC Name: hexadecan-7-yl 2-decyl-3-hexyl-3-hydroxydodecanoate Traditional Name: 2-decyl-3-hexyl-3-hydroxy-lauric acid 1-hexyldecyl ester Formula: C44H88O3 MolecularWeight: 665.16772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C(=O)OC(CCCCCC)CCCCCCCCC)C(CCCCCC)(CCCCCCCCC)O

Isomeric SMILES

CCCCCCCCCCC(C(=O)OC(CCCCCC)CCCCCCCCC)C(CCCCCC)(CCCCCCCCC)O

InChI

InChI=1S/C44H88O3/c1-6-11-16-21-24-26-29-33-38-42(44(46,39-34-20-15-10-5)40-35-30-27-23-18-13-8-3)43(45)47-41(36-31-19-14-9-4)37-32-28-25-22-17-12-7-2/h41-42,46H,6-40H2,1-5H3