6-[5,6-dimethyl-6-(6-oxidanyl-6-oxidanylidene-hexanoyl)oxy-heptoxy]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[5,6-dimethyl-6-(6-oxidanyl-6-oxidanylidene-hexanoyl)oxy-heptoxy]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[6-(6-hydroxy-6-oxo-hexanoyl)oxy-5,6-dimethyl-heptoxy]-6-oxo-hexanoic acid CAS Name: 6-[6-(6-hydroxy-1,6-dioxohexoxy)-5,6-dimethylheptoxy]-6-oxohexanoic acid IUPAC Name: 6-[6-(6-hydroxy-6-oxohexanoyl)oxy-5,6-dimethylheptoxy]-6-oxohexanoic acid Traditional Name: 6-[6-(6-hydroxy-6-keto-hexanoyl)oxy-5,6-dimethyl-heptoxy]-6-keto-hexanoic acid Formula: C21H36O8 MolecularWeight: 416.50574

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCOC(=O)CCCCC(=O)O)C(C)(C)OC(=O)CCCCC(=O)O

Isomeric SMILES

CC(CCCCOC(=O)CCCCC(=O)O)C(C)(C)OC(=O)CCCCC(=O)O

InChI

InChI=1S/C21H36O8/c1-16(21(2,3)29-20(27)14-7-5-12-18(24)25)10-8-9-15-28-19(26)13-6-4-11-17(22)23/h16H,4-15H2,1-3H3,(H,22,23)(H,24,25)