[2-[1-(2-ethylhexanoyloxy)-2-oxidanyl-ethyl]-4-oxidanyl-5-oxidanylidene-2H-furan-3-yl] 2-ethylhexanoate

Systemtic Name: [2-[1-(2-ethylhexanoyloxy)-2-oxidanyl-ethyl]-4-oxidanyl-5-oxidanylidene-2H-furan-3-yl] 2-ethylhexanoate Openeye Name: [2-[1-(2-ethylhexanoyloxy)-2-hydroxy-ethyl]-4-hydroxy-5-oxo-2H-furan-3-yl] 2-ethylhexanoate CAS Name: 2-ethylhexanoic acid [2-[1-(2-ethyl-1-oxohexoxy)-2-hydroxyethyl]-4-hydroxy-5-oxo-2H-furan-3-yl] ester IUPAC Name: [2-[1-(2-ethylhexanoyloxy)-2-hydroxyethyl]-4-hydroxy-5-oxo-2H-furan-3-yl] 2-ethylhexanoate Traditional Name: 2-ethylhexanoic acid [2-[1-(2-ethylhexanoyloxy)-2-hydroxy-ethyl]-4-hydroxy-5-keto-2H-furan-3-yl] ester Formula: C22H36O8 MolecularWeight: 428.51644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)OC1=C(C(=O)OC1C(CO)OC(=O)C(CC)CCCC)O

Isomeric SMILES

CCCCC(CC)C(=O)OC1=C(C(=O)OC1C(CO)OC(=O)C(CC)CCCC)O

InChI

InChI=1S/C22H36O8/c1-5-9-11-14(7-3)20(25)28-16(13-23)18-19(17(24)22(27)29-18)30-21(26)15(8-4)12-10-6-2/h14-16,18,23-24H,5-13H2,1-4H3