[1-oxidanyl-1-phosphono-3-(1,3,5-trimethyl-2-oxidanylidene-imidazol-4-yl)propyl]phosphonic acid

Systemtic Name: [1-oxidanyl-1-phosphono-3-(1,3,5-trimethyl-2-oxidanylidene-imidazol-4-yl)propyl]phosphonic acid Openeye Name: [1-hydroxy-1-phosphono-3-(1,3,5-trimethyl-2-oxo-imidazol-4-yl)propyl]phosphonic acid CAS Name: [1-hydroxy-1-phosphono-3-(1,3,5-trimethyl-2-oxo-4-imidazolyl)propyl]phosphonic acid IUPAC Name: [1-hydroxy-1-phosphono-3-(1,3,5-trimethyl-2-oxoimidazol-4-yl)propyl]phosphonic acid Traditional Name: [1-hydroxy-3-(2-keto-1,3,5-trimethyl-4-imidazolin-4-yl)-1-phosphono-propyl]phosphonic acid Formula: C9H18N2O8P2 MolecularWeight: 344.195342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=O)N1C)C)CCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC1=C(N(C(=O)N1C)C)CCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C9H18N2O8P2/c1-6-7(11(3)8(12)10(6)2)4-5-9(13,20(14,15)16)21(17,18)19/h13H,4-5H2,1-3H3,(H2,14,15,16)(H2,17,18,19)