[2-(2,5-dimethyl-1,3-oxazol-4-yl)-1-oxidanyl-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-(2,5-dimethyl-1,3-oxazol-4-yl)-1-oxidanyl-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(2,5-dimethyloxazol-4-yl)-1-hydroxy-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(2,5-dimethyl-4-oxazolyl)-1-hydroxy-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(2,5-dimethyl-1,3-oxazol-4-yl)-1-hydroxy-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(2,5-dimethyloxazol-4-yl)-1-hydroxy-1-phosphono-ethyl]phosphonic acid Formula: C7H13NO8P2 MolecularWeight: 301.127542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C)CC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC1=C(N=C(O1)C)CC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C7H13NO8P2/c1-4-6(8-5(2)16-4)3-7(9,17(10,11)12)18(13,14)15/h9H,3H2,1-2H3,(H2,10,11,12)(H2,13,14,15)