2-[2-(dioxidanyl)-2-oxidanylidene-ethyl]-2-(14-methylpentadecanoyloxy)butanedioic acid

Systemtic Name: 2-[2-(dioxidanyl)-2-oxidanylidene-ethyl]-2-(14-methylpentadecanoyloxy)butanedioic acid Openeye Name: 2-(2-hydroperoxy-2-oxo-ethyl)-2-(14-methylpentadecanoyloxy)butanedioic acid CAS Name: 2-(2-hydroperoxy-2-oxoethyl)-2-(14-methyl-1-oxopentadecoxy)butanedioic acid IUPAC Name: 2-(2-hydroperoxy-2-oxoethyl)-2-(14-methylpentadecanoyloxy)butanedioic acid Traditional Name: 2-(2-hydroperoxy-2-keto-ethyl)-2-(14-methylpentadecanoyloxy)succinic acid Formula: C22H38O9 MolecularWeight: 446.53172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCC(=O)OC(CC(=O)O)(CC(=O)OO)C(=O)O

Isomeric SMILES

CC(C)CCCCCCCCCCCCC(=O)OC(CC(=O)O)(CC(=O)OO)C(=O)O

InChI

InChI=1S/C22H38O9/c1-17(2)13-11-9-7-5-3-4-6-8-10-12-14-19(25)30-22(21(27)28,15-18(23)24)16-20(26)31-29/h17,29H,3-16H2,1-2H3,(H,23,24)(H,27,28)