2-methoxyethyl 5-ethyl-5-oxidanyl-3,6-bis(oxidanylidene)octanoate

Systemtic Name: 2-methoxyethyl 5-ethyl-5-oxidanyl-3,6-bis(oxidanylidene)octanoate Openeye Name: 2-methoxyethyl 5-ethyl-5-hydroxy-3,6-dioxo-octanoate CAS Name: 5-ethyl-5-hydroxy-3,6-dioxooctanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 5-ethyl-5-hydroxy-3,6-dioxooctanoate Traditional Name: 5-ethyl-5-hydroxy-3,6-diketo-caprylic acid 2-methoxyethyl ester Formula: C13H22O6 MolecularWeight: 274.31018

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CC)(CC(=O)CC(=O)OCCOC)O

Isomeric SMILES

CCC(=O)C(CC)(CC(=O)CC(=O)OCCOC)O

InChI

InChI=1S/C13H22O6/c1-4-11(15)13(17,5-2)9-10(14)8-12(16)19-7-6-18-3/h17H,4-9H2,1-3H3