[2-[1-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]-2,2-dimethyl-cyclopropyl]oxy-2-phosphonato-3-propan-2-yloxycarbonyloxy-propyl] propan-2-yl carbonate

Systemtic Name: [2-[1-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]-2,2-dimethyl-cyclopropyl]oxy-2-phosphonato-3-propan-2-yloxycarbonyloxy-propyl] propan-2-yl carbonate Openeye Name: [2-[1-[(2-amino-6-oxo-3H-purin-9-yl)methyl]-2,2-dimethyl-cyclopropoxy]-3-isopropoxycarbonyloxy-2-phosphonato-propyl] isopropyl carbonate CAS Name: carbonic acid [2-[1-[(2-amino-6-oxo-3H-purin-9-yl)methyl]-2,2-dimethylcyclopropyl]oxy-3-[oxo(propan-2-yloxy)methoxy]-2-phosphonatopropyl] propan-2-yl ester IUPAC Name: [2-[1-[(2-amino-6-oxo-3H-purin-9-yl)methyl]-2,2-dimethylcyclopropyl]oxy-2-phosphonato-3-propan-2-yloxycarbonyloxypropyl] propan-2-yl carbonate Traditional Name: carbonic acid [2-[1-[(2-amino-6-keto-3H-purin-9-yl)methyl]-2,2-dimethyl-cyclopropoxy]-3-isopropoxycarbonyloxy-2-phosphonato-propyl] isopropyl ester Formula: C22H32N5O11P-2 MolecularWeight: 573.490141

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)OCC(COC(=O)OC(C)C)(OC1(CC1(C)C)CN2C=NC3=C2NC(=NC3=O)N)P(=O)([O-])[O-]

Isomeric SMILES

CC(C)OC(=O)OCC(COC(=O)OC(C)C)(OC1(CC1(C)C)CN2C=NC3=C2NC(=NC3=O)N)P(=O)([O-])[O-]

InChI

InChI=1S/C22H34N5O11P/c1-12(2)36-18(29)34-9-22(39(31,32)33,10-35-19(30)37-13(3)4)38-21(7-20(21,5)6)8-27-11-24-14-15(27)25-17(23)26-16(14)28/h11-13H,7-10H2,1-6H3,(H2,31,32,33)(H3,23,25,26,28)/p-2