[4-acetyloxy-2-(6-chloranylpurin-9-yl)-5-methyl-5-(methylcarbamoyl)oxolan-3-yl] ethanoate

Systemtic Name: [4-acetyloxy-2-(6-chloranylpurin-9-yl)-5-methyl-5-(methylcarbamoyl)oxolan-3-yl] ethanoate Openeye Name: [4-acetoxy-2-(6-chloropurin-9-yl)-5-methyl-5-(methylcarbamoyl)tetrahydrofuran-3-yl] acetate CAS Name: acetic acid [4-acetyloxy-2-(6-chloro-9-purinyl)-5-methyl-5-(methylcarbamoyl)-3-oxolanyl] ester IUPAC Name: [4-acetyloxy-2-(6-chloropurin-9-yl)-5-methyl-5-(methylcarbamoyl)oxolan-3-yl] acetate Traditional Name: acetic acid [4-acetoxy-2-(6-chloropurin-9-yl)-5-methyl-5-(methylcarbamoyl)tetrahydrofuran-3-yl] ester Formula: C16H18ClN5O6 MolecularWeight: 411.79702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(OC1N2C=NC3=C2N=CN=C3Cl)(C)C(=O)NC)OC(=O)C

Isomeric SMILES

CC(=O)OC1C(C(OC1N2C=NC3=C2N=CN=C3Cl)(C)C(=O)NC)OC(=O)C

InChI

InChI=1S/C16H18ClN5O6/c1-7(23)26-10-11(27-8(2)24)16(3,15(25)18-4)28-14(10)22-6-21-9-12(17)19-5-20-13(9)22/h5-6,10-11,14H,1-4H3,(H,18,25)