2-[6-chloranyl-9-[3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]purin-2-yl]oxyethanoic acid

Systemtic Name: 2-[6-chloranyl-9-[3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]purin-2-yl]oxyethanoic acid Openeye Name: 2-[6-chloro-9-[3,4-diacetoxy-5-(acetoxymethyl)tetrahydrofuran-2-yl]purin-2-yl]oxyacetic acid CAS Name: 2-[[6-chloro-9-[3,4-diacetyloxy-5-(acetyloxymethyl)-2-oxolanyl]-2-purinyl]oxy]acetic acid IUPAC Name: 2-[6-chloro-9-[3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]purin-2-yl]oxyacetic acid Traditional Name: 2-[6-chloro-9-[3,4-diacetoxy-5-(acetoxymethyl)tetrahydrofuran-2-yl]purin-2-yl]oxyacetic acid Formula: C18H19ClN4O10 MolecularWeight: 486.81726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClN4O10/c1-7(24)29-4-10-13(31-8(2)25)14(32-9(3)26)17(33-10)23-6-20-12-15(19)21-18(22-16(12)23)30-5-11(27)28/h6,10,13-14,17H,4-5H2,1-3H3,(H,27,28)