3-phenyl-2,4-diphosphono-pentanedioic acid

Systemtic Name: 3-phenyl-2,4-diphosphono-pentanedioic acid Openeye Name: 3-phenyl-2,4-diphosphono-pentanedioic acid CAS Name: 3-phenyl-2,4-diphosphonopentanedioic acid IUPAC Name: 3-phenyl-2,4-diphosphonopentanedioic acid Traditional Name: 3-phenyl-2,4-diphosphono-glutaric acid Formula: C11H14O10P2 MolecularWeight: 368.170382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14O10P2/c12-10(13)8(22(16,17)18)7(6-4-2-1-3-5-6)9(11(14)15)23(19,20)21/h1-5,7-9H,(H,12,13)(H,14,15)(H2,16,17,18)(H2,19,20,21)