2-azanyl-9-[(1-fluoranyl-3-oxidanyl-propan-2-yl)oxymethyl]-1-methyl-purin-6-one

Systemtic Name: 2-azanyl-9-[(1-fluoranyl-3-oxidanyl-propan-2-yl)oxymethyl]-1-methyl-purin-6-one Openeye Name: 2-amino-9-[[1-(fluoromethyl)-2-hydroxy-ethoxy]methyl]-1-methyl-purin-6-one CAS Name: 2-amino-9-[(1-fluoro-3-hydroxypropan-2-yl)oxymethyl]-1-methyl-6-purinone IUPAC Name: 2-amino-9-[(1-fluoro-3-hydroxypropan-2-yl)oxymethyl]-1-methylpurin-6-one Traditional Name: 2-amino-9-[[1-(fluoromethyl)-2-hydroxy-ethoxy]methyl]-1-methyl-purin-6-one Formula: C10H14FN5O3 MolecularWeight: 271.248263

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1N)N(C=N2)COC(CO)CF

Isomeric SMILES

CN1C(=O)C2=C(N=C1N)N(C=N2)COC(CO)CF

InChI

InChI=1S/C10H14FN5O3/c1-15-9(18)7-8(14-10(15)12)16(4-13-7)5-19-6(2-11)3-17/h4,6,17H,2-3,5H2,1H3,(H2,12,14)