[1-oxidanyl-5-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-1-phosphono-pentyl]phosphonic acid

Systemtic Name: [1-oxidanyl-5-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-1-phosphono-pentyl]phosphonic acid Openeye Name: [1-hydroxy-5-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1-phosphono-pentyl]phosphonic acid CAS Name: [1-hydroxy-5-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1-phosphonopentyl]phosphonic acid IUPAC Name: [1-hydroxy-5-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1-phosphonopentyl]phosphonic acid Traditional Name: [1-hydroxy-5-(2-keto-1,3-dihydrobenzimidazol-5-yl)-1-phosphono-pentyl]phosphonic acid Formula: C12H18N2O8P2 MolecularWeight: 380.227442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CCCCC(O)(P(=O)(O)O)P(=O)(O)O)NC(=O)N2

Isomeric SMILES

C1=CC2=C(C=C1CCCCC(O)(P(=O)(O)O)P(=O)(O)O)NC(=O)N2

InChI

InChI=1S/C12H18N2O8P2/c15-11-13-9-5-4-8(7-10(9)14-11)3-1-2-6-12(16,23(17,18)19)24(20,21)22/h4-5,7,16H,1-3,6H2,(H2,13,14,15)(H2,17,18,19)(H2,20,21,22)