4-[[3-(2,2-dimethylbutanoyloxy)-2-oxidanyl-propyl]peroxymethyl]cyclobutane-1,2,3-tricarboxylic acid

Systemtic Name: 4-[[3-(2,2-dimethylbutanoyloxy)-2-oxidanyl-propyl]peroxymethyl]cyclobutane-1,2,3-tricarboxylic acid Openeye Name: 4-[[3-(2,2-dimethylbutanoyloxy)-2-hydroxy-propyl]peroxymethyl]cyclobutane-1,2,3-tricarboxylic acid CAS Name: 4-[[3-(2,2-dimethyl-1-oxobutoxy)-2-hydroxypropyl]dioxymethyl]cyclobutane-1,2,3-tricarboxylic acid IUPAC Name: 4-[[3-(2,2-dimethylbutanoyloxy)-2-hydroxypropyl]peroxymethyl]cyclobutane-1,2,3-tricarboxylic acid Traditional Name: 4-[[3-(2,2-dimethylbutanoyloxy)-2-hydroxy-propyl]peroxymethyl]cyclobutane-1,2,3-tricarboxylic acid Formula: C17H26O11 MolecularWeight: 406.38174

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)OCC(COOCC1C(C(C1C(=O)O)C(=O)O)C(=O)O)O

Isomeric SMILES

CCC(C)(C)C(=O)OCC(COOCC1C(C(C1C(=O)O)C(=O)O)C(=O)O)O

InChI

InChI=1S/C17H26O11/c1-4-17(2,3)16(25)26-5-8(18)6-27-28-7-9-10(13(19)20)12(15(23)24)11(9)14(21)22/h8-12,18H,4-7H2,1-3H3,(H,19,20)(H,21,22)(H,23,24)