2-ethyl-5-(oxan-2-yloxy)-3-oxidanyl-docosanoic acid

Systemtic Name: 2-ethyl-5-(oxan-2-yloxy)-3-oxidanyl-docosanoic acid Openeye Name: 2-ethyl-3-hydroxy-5-tetrahydropyran-2-yloxy-docosanoic acid CAS Name: 2-ethyl-3-hydroxy-5-(2-oxanyloxy)docosanoic acid IUPAC Name: 2-ethyl-3-hydroxy-5-(oxan-2-yloxy)docosanoic acid Traditional Name: 2-ethyl-3-hydroxy-5-tetrahydropyran-2-yloxy-behenic acid Formula: C29H56O5 MolecularWeight: 484.75194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(CC(C(CC)C(=O)O)O)OC1CCCCO1

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(CC(C(CC)C(=O)O)O)OC1CCCCO1

InChI

InChI=1S/C29H56O5/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25(34-28-22-19-20-23-33-28)24-27(30)26(4-2)29(31)32/h25-28,30H,3-24H2,1-2H3,(H,31,32)