[2-azanyl-1-[5,5-bis(fluoranyl)pentyl]-6-oxidanylidene-purin-7-yl]phosphonic acid

Systemtic Name: [2-azanyl-1-[5,5-bis(fluoranyl)pentyl]-6-oxidanylidene-purin-7-yl]phosphonic acid Openeye Name: [2-amino-1-(5,5-difluoropentyl)-6-oxo-purin-7-yl]phosphonic acid CAS Name: [2-amino-1-(5,5-difluoropentyl)-6-oxo-7-purinyl]phosphonic acid IUPAC Name: [2-amino-1-(5,5-difluoropentyl)-6-oxopurin-7-yl]phosphonic acid Traditional Name: [2-amino-1-(5,5-difluoropentyl)-6-keto-purin-7-yl]phosphonic acid Formula: C10H14F2N5O4P MolecularWeight: 337.219827

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1P(=O)(O)O)C(=O)N(C(=N2)N)CCCCC(F)F

Isomeric SMILES

C1=NC2=C(N1P(=O)(O)O)C(=O)N(C(=N2)N)CCCCC(F)F

InChI

InChI=1S/C10H14F2N5O4P/c11-6(12)3-1-2-4-16-9(18)7-8(15-10(16)13)14-5-17(7)22(19,20)21/h5-6H,1-4H2,(H2,13,15)(H2,19,20,21)