bis[3,4-dicarboxy-1,6-bis(oxidanyl)-1,6-bis(oxidanylidene)hexan-2-yl]phosphinate

Systemtic Name: bis[3,4-dicarboxy-1,6-bis(oxidanyl)-1,6-bis(oxidanylidene)hexan-2-yl]phosphinate Openeye Name: bis(1,2,3-tricarboxy-5-hydroxy-5-oxo-pentyl)phosphinate CAS Name: bis(3,4-dicarboxy-1,6-dihydroxy-1,6-dioxohexan-2-yl)phosphinate IUPAC Name: bis(3,4-dicarboxy-1,6-dihydroxy-1,6-dioxohexan-2-yl)phosphinate Traditional Name: bis(1,2,3-tricarboxy-5-hydroxy-5-keto-pentyl)phosphinate Formula: C16H18O18P- MolecularWeight: 529.277081

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(C(C(=O)O)P(=O)(C(C(C(CC(=O)O)C(=O)O)C(=O)O)C(=O)O)[O-])C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C(C(C(C(C(=O)O)P(=O)(C(C(C(CC(=O)O)C(=O)O)C(=O)O)C(=O)O)[O-])C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C16H19O18P/c17-5(18)1-3(11(21)22)7(13(25)26)9(15(29)30)35(33,34)10(16(31)32)8(14(27)28)4(12(23)24)2-6(19)20/h3-4,7-10H,1-2H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)(H,25,26)(H,27,28)(H,29,30)(H,31,32)(H,33,34)/p-1