methyl 5-ethyl-4-methoxy-5-oxidanyl-3,6-bis(oxidanylidene)octanoate

Systemtic Name: methyl 5-ethyl-4-methoxy-5-oxidanyl-3,6-bis(oxidanylidene)octanoate Openeye Name: methyl 5-ethyl-5-hydroxy-4-methoxy-3,6-dioxo-octanoate CAS Name: 5-ethyl-5-hydroxy-4-methoxy-3,6-dioxooctanoic acid methyl ester IUPAC Name: methyl 5-ethyl-5-hydroxy-4-methoxy-3,6-dioxooctanoate Traditional Name: 5-ethyl-5-hydroxy-3,6-diketo-4-methoxy-caprylic acid methyl ester Formula: C12H20O6 MolecularWeight: 260.2836

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CC)(C(C(=O)CC(=O)OC)OC)O

Isomeric SMILES

CCC(=O)C(CC)(C(C(=O)CC(=O)OC)OC)O

InChI

InChI=1S/C12H20O6/c1-5-9(14)12(16,6-2)11(18-4)8(13)7-10(15)17-3/h11,16H,5-7H2,1-4H3