2-hexyl-5-(oxan-2-yloxy)-3-oxidanyl-hexadecanoate

Systemtic Name: 2-hexyl-5-(oxan-2-yloxy)-3-oxidanyl-hexadecanoate Openeye Name: 2-hexyl-3-hydroxy-5-tetrahydropyran-2-yloxy-hexadecanoate CAS Name: 2-hexyl-3-hydroxy-5-(2-oxanyloxy)hexadecanoate IUPAC Name: 2-hexyl-3-hydroxy-5-(oxan-2-yloxy)hexadecanoate Traditional Name: 2-hexyl-3-hydroxy-5-tetrahydropyran-2-yloxy-palmitate Formula: C27H51O5- MolecularWeight: 455.69084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(C(CCCCCC)C(=O)[O-])O)OC1CCCCO1

Isomeric SMILES

CCCCCCCCCCCC(CC(C(CCCCCC)C(=O)[O-])O)OC1CCCCO1

InChI

InChI=1S/C27H52O5/c1-3-5-7-9-10-11-12-13-14-18-23(32-26-20-16-17-21-31-26)22-25(28)24(27(29)30)19-15-8-6-4-2/h23-26,28H,3-22H2,1-2H3,(H,29,30)/p-1