[1-azanyl-2-(1H-imidazol-5-yl)-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [1-azanyl-2-(1H-imidazol-5-yl)-1-phosphono-ethyl]phosphonic acid Openeye Name: [1-amino-2-(1H-imidazol-5-yl)-1-phosphono-ethyl]phosphonic acid CAS Name: [1-amino-2-(1H-imidazol-5-yl)-1-phosphonoethyl]phosphonic acid IUPAC Name: [1-amino-2-(1H-imidazol-5-yl)-1-phosphonoethyl]phosphonic acid Traditional Name: [1-amino-2-(1H-imidazol-5-yl)-1-phosphono-ethyl]phosphonic acid Formula: C5H11N3O6P2 MolecularWeight: 271.104862

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CC(N)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=C(NC=N1)CC(N)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C5H11N3O6P2/c6-5(15(9,10)11,16(12,13)14)1-4-2-7-3-8-4/h2-3H,1,6H2,(H,7,8)(H2,9,10,11)(H2,12,13,14)