2-[3-(oxan-2-yloxy)-1-oxidanyl-butyl]octadecanoic acid

Systemtic Name: 2-[3-(oxan-2-yloxy)-1-oxidanyl-butyl]octadecanoic acid Openeye Name: 2-(1-hydroxy-3-tetrahydropyran-2-yloxy-butyl)octadecanoic acid CAS Name: 2-[1-hydroxy-3-(2-oxanyloxy)butyl]octadecanoic acid IUPAC Name: 2-[1-hydroxy-3-(oxan-2-yloxy)butyl]octadecanoic acid Traditional Name: 2-(1-hydroxy-3-tetrahydropyran-2-yloxy-butyl)stearic acid Formula: C27H52O5 MolecularWeight: 456.69878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(CC(C)OC1CCCCO1)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(CC(C)OC1CCCCO1)O)C(=O)O

InChI

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