2-[4-(2-carboxyphenyl)carbonylperoxy-4-methyl-pentan-2-yl]oxycarbonylbenzoic acid

Systemtic Name: 2-[4-(2-carboxyphenyl)carbonylperoxy-4-methyl-pentan-2-yl]oxycarbonylbenzoic acid Openeye Name: 2-[3-(2-carboxybenzoyl)peroxy-1,3-dimethyl-butoxy]carbonylbenzoic acid CAS Name: 2-[[4-[(2-carboxyphenyl)-oxomethyl]dioxy-4-methylpentan-2-yl]oxy-oxomethyl]benzoic acid IUPAC Name: 2-[4-(2-carboxybenzoyl)peroxy-4-methylpentan-2-yl]oxycarbonylbenzoic acid Traditional Name: 2-[3-(2-carboxybenzoyl)peroxy-1,3-dimethyl-butoxy]carbonylbenzoic acid Formula: C22H22O9 MolecularWeight: 430.40468

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(C)OOC(=O)C1=CC=CC=C1C(=O)O)OC(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(CC(C)(C)OOC(=O)C1=CC=CC=C1C(=O)O)OC(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C22H22O9/c1-13(29-20(27)16-10-6-4-8-14(16)18(23)24)12-22(2,3)31-30-21(28)17-11-7-5-9-15(17)19(25)26/h4-11,13H,12H2,1-3H3,(H,23,24)(H,25,26)