[2-(2-azanylpurin-9-yl)-4-[[(4-fluoranylphenoxy)-oxidanyl-phosphoryl]oxymethyl]cyclobutyl]methyl (4-fluorophenyl) hydrogen phosphate

Systemtic Name: [2-(2-azanylpurin-9-yl)-4-[[(4-fluoranylphenoxy)-oxidanyl-phosphoryl]oxymethyl]cyclobutyl]methyl (4-fluorophenyl) hydrogen phosphate Openeye Name: [2-(2-aminopurin-9-yl)-4-[[(4-fluorophenoxy)-hydroxy-phosphoryl]oxymethyl]cyclobutyl]methyl (4-fluorophenyl) hydrogen phosphate CAS Name: [2-(2-amino-9-purinyl)-4-[[(4-fluorophenoxy)-hydroxyphosphoryl]oxymethyl]cyclobutyl]methyl (4-fluorophenyl) hydrogen phosphate IUPAC Name: [2-(2-aminopurin-9-yl)-4-[[(4-fluorophenoxy)-hydroxyphosphoryl]oxymethyl]cyclobutyl]methyl (4-fluorophenyl) hydrogen phosphate Traditional Name: [2-(2-aminopurin-9-yl)-4-[[(4-fluorophenoxy)-hydroxy-phosphoryl]oxymethyl]cyclobutyl]methyl (4-fluorophenyl) hydrogen phosphate Formula: C23H23F2N5O8P2 MolecularWeight: 597.401748

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C1N2C=NC3=CN=C(N=C32)N)COP(=O)(O)OC4=CC=C(C=C4)F)COP(=O)(O)OC5=CC=C(C=C5)F

Isomeric SMILES

C1C(C(C1N2C=NC3=CN=C(N=C32)N)COP(=O)(O)OC4=CC=C(C=C4)F)COP(=O)(O)OC5=CC=C(C=C5)F

InChI

InChI=1S/C23H23F2N5O8P2/c24-15-1-5-17(6-2-15)37-39(31,32)35-11-14-9-21(30-13-28-20-10-27-23(26)29-22(20)30)19(14)12-36-40(33,34)38-18-7-3-16(25)4-8-18/h1-8,10,13-14,19,21H,9,11-12H2,(H,31,32)(H,33,34)(H2,26,27,29)