1-(6-aminopurin-9-yl)-3-azido-2,2-bis(fluoranyl)-4,5-bis(oxidanyl)pentan-1-one

Systemtic Name: 1-(6-aminopurin-9-yl)-3-azido-2,2-bis(fluoranyl)-4,5-bis(oxidanyl)pentan-1-one Openeye Name: 1-(6-aminopurin-9-yl)-3-azido-2,2-difluoro-4,5-dihydroxy-pentan-1-one CAS Name: 1-(6-aminopurin-9-yl)-3-azido-2,2-difluoro-4,5-dihydroxy-1-pentanone IUPAC Name: 1-(6-aminopurin-9-yl)-3-azido-2,2-difluoro-4,5-dihydroxypentan-1-one Traditional Name: 1-adenin-9-yl-3-azido-2,2-difluoro-4,5-dihydroxy-pentan-1-one Formula: C10H10F2N8O3 MolecularWeight: 328.235006

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2C(=O)C(C(C(CO)O)N=[N+]=[N-])(F)F

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2C(=O)C(C(C(CO)O)N=[N+]=[N-])(F)F

InChI

InChI=1S/C10H10F2N8O3/c11-10(12,6(18-19-14)4(22)1-21)9(23)20-3-17-5-7(13)15-2-16-8(5)20/h2-4,6,21-22H,1H2,(H2,13,15,16)