[2-ethyl-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl] octanoate

Systemtic Name: [2-ethyl-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl] octanoate Openeye Name: [2-ethyl-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] octanoate CAS Name: octanoic acid [2-ethyl-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl] ester IUPAC Name: [2-ethyl-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] octanoate Traditional Name: caprylic acid (2-ethyl-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl) ester Formula: C16H30O7 MolecularWeight: 334.4052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1(C(C(C(C(O1)CO)O)O)O)CC

Isomeric SMILES

CCCCCCCC(=O)OC1(C(C(C(C(O1)CO)O)O)O)CC

InChI

InChI=1S/C16H30O7/c1-3-5-6-7-8-9-12(18)23-16(4-2)15(21)14(20)13(19)11(10-17)22-16/h11,13-15,17,19-21H,3-10H2,1-2H3