3-[5-(2,2-dimethylbutanoyloxy)-4-oxidanyl-pentanoyl]-4-(dioxidanylmethyl)cyclobutane-1,2-dicarboxylic acid

Systemtic Name: 3-[5-(2,2-dimethylbutanoyloxy)-4-oxidanyl-pentanoyl]-4-(dioxidanylmethyl)cyclobutane-1,2-dicarboxylic acid Openeye Name: 3-[5-(2,2-dimethylbutanoyloxy)-4-hydroxy-pentanoyl]-4-(hydroperoxymethyl)cyclobutane-1,2-dicarboxylic acid CAS Name: 3-[5-(2,2-dimethyl-1-oxobutoxy)-4-hydroxy-1-oxopentyl]-4-(hydroperoxymethyl)cyclobutane-1,2-dicarboxylic acid IUPAC Name: 3-[5-(2,2-dimethylbutanoyloxy)-4-hydroxypentanoyl]-4-(hydroperoxymethyl)cyclobutane-1,2-dicarboxylic acid Traditional Name: 3-[5-(2,2-dimethylbutanoyloxy)-4-hydroxy-pentanoyl]-4-(hydroperoxymethyl)cyclobutane-1,2-dicarboxylic acid Formula: C18H28O10 MolecularWeight: 404.40892

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)OCC(CCC(=O)C1C(C(C1C(=O)O)C(=O)O)COO)O

Isomeric SMILES

CCC(C)(C)C(=O)OCC(CCC(=O)C1C(C(C1C(=O)O)C(=O)O)COO)O

InChI

InChI=1S/C18H28O10/c1-4-18(2,3)17(25)27-7-9(19)5-6-11(20)12-10(8-28-26)13(15(21)22)14(12)16(23)24/h9-10,12-14,19,26H,4-8H2,1-3H3,(H,21,22)(H,23,24)