2-methyl-5-octanoyloxy-hexanoic acid

Systemtic Name: 2-methyl-5-octanoyloxy-hexanoic acid Openeye Name: 2-methyl-5-octanoyloxy-hexanoic acid CAS Name: 2-methyl-5-(1-oxooctoxy)hexanoic acid IUPAC Name: 2-methyl-5-octanoyloxyhexanoic acid Traditional Name: 5-caprylyloxy-2-methyl-hexanoic acid Formula: C15H28O4 MolecularWeight: 272.38042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC(C)CCC(C)C(=O)O

Isomeric SMILES

CCCCCCCC(=O)OC(C)CCC(C)C(=O)O

InChI

InChI=1S/C15H28O4/c1-4-5-6-7-8-9-14(16)19-13(3)11-10-12(2)15(17)18/h12-13H,4-11H2,1-3H3,(H,17,18)