2-[2-[4-(3-carboxyundecanoylperoxy)-4-methyl-pentan-2-yl]oxy-2-oxidanylidene-ethyl]decanoic acid

Systemtic Name: 2-[2-[4-(3-carboxyundecanoylperoxy)-4-methyl-pentan-2-yl]oxy-2-oxidanylidene-ethyl]decanoic acid Openeye Name: 2-[2-[3-(3-carboxyundecanoylperoxy)-1,3-dimethyl-butoxy]-2-oxo-ethyl]decanoic acid CAS Name: 2-[2-[4-(3-carboxy-1-oxoundecyl)dioxy-4-methylpentan-2-yl]oxy-2-oxoethyl]decanoic acid IUPAC Name: 2-[2-[4-(3-carboxyundecanoylperoxy)-4-methylpentan-2-yl]oxy-2-oxoethyl]decanoic acid Traditional Name: 2-[2-[3-(3-carboxyundecanoylperoxy)-1,3-dimethyl-butoxy]-2-keto-ethyl]capric acid Formula: C30H54O9 MolecularWeight: 558.74436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CC(=O)OC(C)CC(C)(C)OOC(=O)CC(CCCCCCCC)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCC(CC(=O)OC(C)CC(C)(C)OOC(=O)CC(CCCCCCCC)C(=O)O)C(=O)O

InChI

InChI=1S/C30H54O9/c1-6-8-10-12-14-16-18-24(28(33)34)20-26(31)37-23(3)22-30(4,5)39-38-27(32)21-25(29(35)36)19-17-15-13-11-9-7-2/h23-25H,6-22H2,1-5H3,(H,33,34)(H,35,36)