[1-(1H-imidazol-5-yl)-1-phosphono-propyl]phosphonic acid

Systemtic Name: [1-(1H-imidazol-5-yl)-1-phosphono-propyl]phosphonic acid Openeye Name: [1-(1H-imidazol-5-yl)-1-phosphono-propyl]phosphonic acid CAS Name: [1-(1H-imidazol-5-yl)-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-(1H-imidazol-5-yl)-1-phosphonopropyl]phosphonic acid Traditional Name: [1-(1H-imidazol-5-yl)-1-phosphono-propyl]phosphonic acid Formula: C6H12N2O6P2 MolecularWeight: 270.116802

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CN=CN1)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCC(C1=CN=CN1)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H12N2O6P2/c1-2-6(15(9,10)11,16(12,13)14)5-3-7-4-8-5/h3-4H,2H2,1H3,(H,7,8)(H2,9,10,11)(H2,12,13,14)