3-[2-(carboxymethyl)-2,4-bis(oxidanyl)-4-oxidanylidene-butanoyl]peroxycarbonyl-3-oxidanyl-pentanedioic acid

Systemtic Name: 3-[2-(carboxymethyl)-2,4-bis(oxidanyl)-4-oxidanylidene-butanoyl]peroxycarbonyl-3-oxidanyl-pentanedioic acid Openeye Name: 3-[2-(carboxymethyl)-2,4-dihydroxy-4-oxo-butanoyl]peroxycarbonyl-3-hydroxy-pentanedioic acid CAS Name: 3-[[2-(carboxymethyl)-2,4-dihydroxy-1,4-dioxobutyl]dioxy-oxomethyl]-3-hydroxypentanedioic acid IUPAC Name: 3-[2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoyl]peroxycarbonyl-3-hydroxypentanedioic acid Traditional Name: 3-[2-(carboxymethyl)-2,4-dihydroxy-4-keto-butanoyl]peroxycarbonyl-3-hydroxy-glutaric acid Formula: C12H14O14 MolecularWeight: 382.23116

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)O)C(CC(=O)O)(C(=O)OOC(=O)C(CC(=O)O)(CC(=O)O)O)O

Isomeric SMILES

C(C(=O)O)C(CC(=O)O)(C(=O)OOC(=O)C(CC(=O)O)(CC(=O)O)O)O

InChI

InChI=1S/C12H14O14/c13-5(14)1-11(23,2-6(15)16)9(21)25-26-10(22)12(24,3-7(17)18)4-8(19)20/h23-24H,1-4H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20)