tert-butyl 2-[6-chloranyl-9-[3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]purin-2-yl]oxyethanoate

Systemtic Name: tert-butyl 2-[6-chloranyl-9-[3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]purin-2-yl]oxyethanoate Openeye Name: tert-butyl 2-[6-chloro-9-[3,4-diacetoxy-5-(acetoxymethyl)tetrahydrofuran-2-yl]purin-2-yl]oxyacetate CAS Name: 2-[[6-chloro-9-[3,4-diacetyloxy-5-(acetyloxymethyl)-2-oxolanyl]-2-purinyl]oxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[6-chloro-9-[3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]purin-2-yl]oxyacetate Traditional Name: 2-[6-chloro-9-[3,4-diacetoxy-5-(acetoxymethyl)tetrahydrofuran-2-yl]purin-2-yl]oxyacetic acid tert-butyl ester Formula: C22H27ClN4O10 MolecularWeight: 542.92358

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=C(N=C3Cl)OCC(=O)OC(C)(C)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=C(N=C3Cl)OCC(=O)OC(C)(C)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C22H27ClN4O10/c1-10(28)32-7-13-16(34-11(2)29)17(35-12(3)30)20(36-13)27-9-24-15-18(23)25-21(26-19(15)27)33-8-14(31)37-22(4,5)6/h9,13,16-17,20H,7-8H2,1-6H3