(6-ethyl-3,4,5-trimethyl-oxan-2-yl) octanoate

Systemtic Name: (6-ethyl-3,4,5-trimethyl-oxan-2-yl) octanoate Openeye Name: (6-ethyl-3,4,5-trimethyl-tetrahydropyran-2-yl) octanoate CAS Name: octanoic acid (6-ethyl-3,4,5-trimethyl-2-oxanyl) ester IUPAC Name: (6-ethyl-3,4,5-trimethyloxan-2-yl) octanoate Traditional Name: caprylic acid (6-ethyl-3,4,5-trimethyl-tetrahydropyran-2-yl) ester Formula: C18H34O3 MolecularWeight: 298.46076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1C(C(C(C(O1)CC)C)C)C

Isomeric SMILES

CCCCCCCC(=O)OC1C(C(C(C(O1)CC)C)C)C

InChI

InChI=1S/C18H34O3/c1-6-8-9-10-11-12-17(19)21-18-15(5)13(3)14(4)16(7-2)20-18/h13-16,18H,6-12H2,1-5H3