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

Systemtic Name: 4-[5-(2,2-dimethylbutanoyloxy)-4-oxidanyl-pentanoyl]cyclobutane-1,2,3-tricarboxylic acid Openeye Name: 4-[5-(2,2-dimethylbutanoyloxy)-4-hydroxy-pentanoyl]cyclobutane-1,2,3-tricarboxylic acid CAS Name: 4-[5-(2,2-dimethyl-1-oxobutoxy)-4-hydroxy-1-oxopentyl]cyclobutane-1,2,3-tricarboxylic acid IUPAC Name: 4-[5-(2,2-dimethylbutanoyloxy)-4-hydroxypentanoyl]cyclobutane-1,2,3-tricarboxylic acid Traditional Name: 4-[5-(2,2-dimethylbutanoyloxy)-4-hydroxy-pentanoyl]cyclobutane-1,2,3-tricarboxylic acid Formula: C18H26O10 MolecularWeight: 402.39304

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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)C(=O)O)O

Isomeric SMILES

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

InChI

InChI=1S/C18H26O10/c1-4-18(2,3)17(27)28-7-8(19)5-6-9(20)10-11(14(21)22)13(16(25)26)12(10)15(23)24/h8,10-13,19H,4-7H2,1-3H3,(H,21,22)(H,23,24)(H,25,26)