[3-(3H-benzimidazol-5-yl)-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-(3H-benzimidazol-5-yl)-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [3-(3H-benzimidazol-5-yl)-1-hydroxy-1-phosphono-propyl]phosphonic acid CAS Name: [3-(3H-benzimidazol-5-yl)-1-hydroxy-1-phosphonopropyl]phosphonic acid IUPAC Name: [3-(3H-benzimidazol-5-yl)-1-hydroxy-1-phosphonopropyl]phosphonic acid Traditional Name: [3-(3H-benzimidazol-5-yl)-1-hydroxy-1-phosphono-propyl]phosphonic acid Formula: C10H14N2O7P2 MolecularWeight: 336.174882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CCC(O)(P(=O)(O)O)P(=O)(O)O)NC=N2

Isomeric SMILES

C1=CC2=C(C=C1CCC(O)(P(=O)(O)O)P(=O)(O)O)NC=N2

InChI

InChI=1S/C10H14N2O7P2/c13-10(20(14,15)16,21(17,18)19)4-3-7-1-2-8-9(5-7)12-6-11-8/h1-2,5-6,13H,3-4H2,(H,11,12)(H2,14,15,16)(H2,17,18,19)