[2-[3,5-bis(fluoranyl)pyridin-1-ium-1-yl]-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-[3,5-bis(fluoranyl)pyridin-1-ium-1-yl]-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(3,5-difluoropyridin-1-ium-1-yl)-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(3,5-difluoro-1-pyridin-1-iumyl)-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(3,5-difluoropyridin-1-ium-1-yl)-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(3,5-difluoropyridin-1-ium-1-yl)-1-phosphono-ethyl]phosphonic acid Formula: C7H10F2NO6P2+ MolecularWeight: 304.101728

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=[N+](C=C1F)CC(P(=O)(O)O)P(=O)(O)O)F

Isomeric SMILES

C1=C(C=[N+](C=C1F)CC(P(=O)(O)O)P(=O)(O)O)F

InChI

InChI=1S/C7H9F2NO6P2/c8-5-1-6(9)3-10(2-5)4-7(17(11,12)13)18(14,15)16/h1-3,7H,4H2,(H3-,11,12,13,14,15,16)/p+1