[1,1-bis(fluoranyl)-5-(6-oxidanylidene-3H-purin-9-yl)pent-1-en-3-yl]phosphonic acid

Systemtic Name: [1,1-bis(fluoranyl)-5-(6-oxidanylidene-3H-purin-9-yl)pent-1-en-3-yl]phosphonic acid Openeye Name: [3,3-difluoro-1-[2-(6-oxo-3H-purin-9-yl)ethyl]allyl]phosphonic acid CAS Name: [1,1-difluoro-5-(6-oxo-3H-purin-9-yl)pent-1-en-3-yl]phosphonic acid IUPAC Name: [1,1-difluoro-5-(6-oxo-3H-purin-9-yl)pent-1-en-3-yl]phosphonic acid Traditional Name: [3,3-difluoro-1-[2-(6-keto-3H-purin-9-yl)ethyl]allyl]phosphonic acid Formula: C10H11F2N4O4P MolecularWeight: 320.189307

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=O)C2=C(N1)N(C=N2)CCC(C=C(F)F)P(=O)(O)O

Isomeric SMILES

C1=NC(=O)C2=C(N1)N(C=N2)CCC(C=C(F)F)P(=O)(O)O

InChI

InChI=1S/C10H11F2N4O4P/c11-7(12)3-6(21(18,19)20)1-2-16-5-15-8-9(16)13-4-14-10(8)17/h3-6H,1-2H2,(H,13,14,17)(H2,18,19,20)