2-[2-carboxypentyl(oxidanyl)phosphoryl]-2-methyl-pentanedioic acid

Systemtic Name: 2-[2-carboxypentyl(oxidanyl)phosphoryl]-2-methyl-pentanedioic acid Openeye Name: 2-[2-carboxypentyl(hydroxy)phosphoryl]-2-methyl-pentanedioic acid CAS Name: 2-[2-carboxypentyl(hydroxy)phosphoryl]-2-methylpentanedioic acid IUPAC Name: 2-[2-carboxypentyl(hydroxy)phosphoryl]-2-methylpentanedioic acid Traditional Name: 2-[2-carboxypentyl(hydroxy)phosphoryl]-2-methyl-glutaric acid Formula: C12H21O8P MolecularWeight: 324.264101

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CP(=O)(C(C)(CCC(=O)O)C(=O)O)O)C(=O)O

Isomeric SMILES

CCCC(CP(=O)(C(C)(CCC(=O)O)C(=O)O)O)C(=O)O

InChI

InChI=1S/C12H21O8P/c1-3-4-8(10(15)16)7-21(19,20)12(2,11(17)18)6-5-9(13)14/h8H,3-7H2,1-2H3,(H,13,14)(H,15,16)(H,17,18)(H,19,20)