2-(3-hydroxyphenyl)-2,4-diphosphono-pentanedioic acid

Systemtic Name: 2-(3-hydroxyphenyl)-2,4-diphosphono-pentanedioic acid Openeye Name: 2-(3-hydroxyphenyl)-2,4-diphosphono-pentanedioic acid CAS Name: 2-(3-hydroxyphenyl)-2,4-diphosphonopentanedioic acid IUPAC Name: 2-(3-hydroxyphenyl)-2,4-diphosphonopentanedioic acid Traditional Name: 2-(3-hydroxyphenyl)-2,4-diphosphono-glutaric acid Formula: C11H14O11P2 MolecularWeight: 384.169782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)C(CC(C(=O)O)P(=O)(O)O)(C(=O)O)P(=O)(O)O

Isomeric SMILES

C1=CC(=CC(=C1)O)C(CC(C(=O)O)P(=O)(O)O)(C(=O)O)P(=O)(O)O

InChI

InChI=1S/C11H14O11P2/c12-7-3-1-2-6(4-7)11(10(15)16,24(20,21)22)5-8(9(13)14)23(17,18)19/h1-4,8,12H,5H2,(H,13,14)(H,15,16)(H2,17,18,19)(H2,20,21,22)