[3-(2-methyl-1H-imidazol-5-yl)-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-(2-methyl-1H-imidazol-5-yl)-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [1-hydroxy-3-(2-methyl-1H-imidazol-5-yl)-1-phosphono-propyl]phosphonic acid CAS Name: [1-hydroxy-3-(2-methyl-1H-imidazol-5-yl)-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-hydroxy-3-(2-methyl-1H-imidazol-5-yl)-1-phosphonopropyl]phosphonic acid Traditional Name: [1-hydroxy-3-(2-methyl-1H-imidazol-5-yl)-1-phosphono-propyl]phosphonic acid Formula: C7H14N2O7P2 MolecularWeight: 300.142782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1)CCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC1=NC=C(N1)CCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C7H14N2O7P2/c1-5-8-4-6(9-5)2-3-7(10,17(11,12)13)18(14,15)16/h4,10H,2-3H2,1H3,(H,8,9)(H2,11,12,13)(H2,14,15,16)