[2-(imidazol-1-ylmethoxy)-1-oxidanyl-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-(imidazol-1-ylmethoxy)-1-oxidanyl-1-phosphono-ethyl]phosphonic acid Openeye Name: [1-hydroxy-2-(imidazol-1-ylmethoxy)-1-phosphono-ethyl]phosphonic acid CAS Name: [1-hydroxy-2-(1-imidazolylmethoxy)-1-phosphonoethyl]phosphonic acid IUPAC Name: [1-hydroxy-2-(imidazol-1-ylmethoxy)-1-phosphonoethyl]phosphonic acid Traditional Name: [1-hydroxy-2-(imidazol-1-ylmethoxy)-1-phosphono-ethyl]phosphonic acid Formula: C6H12N2O8P2 MolecularWeight: 302.115602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)COCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CN(C=N1)COCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H12N2O8P2/c9-6(17(10,11)12,18(13,14)15)3-16-5-8-2-1-7-4-8/h1-2,4,9H,3,5H2,(H2,10,11,12)(H2,13,14,15)