[2-[1-(1H-imidazol-2-yl)propan-2-yloxy]-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-[1-(1H-imidazol-2-yl)propan-2-yloxy]-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-[2-(1H-imidazol-2-yl)-1-methyl-ethoxy]-1-phosphono-ethyl]phosphonic acid CAS Name: [2-[1-(1H-imidazol-2-yl)propan-2-yloxy]-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-[1-(1H-imidazol-2-yl)propan-2-yloxy]-1-phosphonoethyl]phosphonic acid Traditional Name: [2-[2-(1H-imidazol-2-yl)-1-methyl-ethoxy]-1-phosphono-ethyl]phosphonic acid Formula: C8H16N2O7P2 MolecularWeight: 314.169362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NC=CN1)OCC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC(CC1=NC=CN1)OCC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C8H16N2O7P2/c1-6(4-7-9-2-3-10-7)17-5-8(18(11,12)13)19(14,15)16/h2-3,6,8H,4-5H2,1H3,(H,9,10)(H2,11,12,13)(H2,14,15,16)