2-(furan-2-ylmethyl)-2,4-diphosphono-pentanedioic acid

Systemtic Name: 2-(furan-2-ylmethyl)-2,4-diphosphono-pentanedioic acid Openeye Name: 2-(2-furylmethyl)-2,4-diphosphono-pentanedioic acid CAS Name: 2-(2-furanylmethyl)-2,4-diphosphonopentanedioic acid IUPAC Name: 2-(furan-2-ylmethyl)-2,4-diphosphonopentanedioic acid Traditional Name: 2-(2-furfuryl)-2,4-diphosphono-glutaric acid Formula: C10H14O11P2 MolecularWeight: 372.159082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14O11P2/c11-8(12)7(22(15,16)17)5-10(9(13)14,23(18,19)20)4-6-2-1-3-21-6/h1-3,7H,4-5H2,(H,11,12)(H,13,14)(H2,15,16,17)(H2,18,19,20)