2-[2-(1H-imidazol-2-yl)ethyl]-2,4-diphosphono-pentanedioic acid

Systemtic Name: 2-[2-(1H-imidazol-2-yl)ethyl]-2,4-diphosphono-pentanedioic acid Openeye Name: 2-[2-(1H-imidazol-2-yl)ethyl]-2,4-diphosphono-pentanedioic acid CAS Name: 2-[2-(1H-imidazol-2-yl)ethyl]-2,4-diphosphonopentanedioic acid IUPAC Name: 2-[2-(1H-imidazol-2-yl)ethyl]-2,4-diphosphonopentanedioic acid Traditional Name: 2-[2-(1H-imidazol-2-yl)ethyl]-2,4-diphosphono-glutaric acid Formula: C10H16N2O10P2 MolecularWeight: 386.188962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N1)CCC(CC(C(=O)O)P(=O)(O)O)(C(=O)O)P(=O)(O)O

Isomeric SMILES

C1=CN=C(N1)CCC(CC(C(=O)O)P(=O)(O)O)(C(=O)O)P(=O)(O)O

InChI

InChI=1S/C10H16N2O10P2/c13-8(14)6(23(17,18)19)5-10(9(15)16,24(20,21)22)2-1-7-11-3-4-12-7/h3-4,6H,1-2,5H2,(H,11,12)(H,13,14)(H,15,16)(H2,17,18,19)(H2,20,21,22)