[2-acetyloxy-2-(6-chloranylpurin-9-yl)-5-(5-ethyl-1,3-oxazol-2-yl)oxolan-3-yl] ethanoate

Systemtic Name: [2-acetyloxy-2-(6-chloranylpurin-9-yl)-5-(5-ethyl-1,3-oxazol-2-yl)oxolan-3-yl] ethanoate Openeye Name: [2-acetoxy-2-(6-chloropurin-9-yl)-5-(5-ethyloxazol-2-yl)tetrahydrofuran-3-yl] acetate CAS Name: acetic acid [2-acetyloxy-2-(6-chloro-9-purinyl)-5-(5-ethyl-2-oxazolyl)-3-oxolanyl] ester IUPAC Name: [2-acetyloxy-2-(6-chloropurin-9-yl)-5-(5-ethyl-1,3-oxazol-2-yl)oxolan-3-yl] acetate Traditional Name: acetic acid [2-acetoxy-2-(6-chloropurin-9-yl)-5-(5-ethyloxazol-2-yl)tetrahydrofuran-3-yl] ester Formula: C18H18ClN5O6 MolecularWeight: 435.81842

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(O1)C2CC(C(O2)(N3C=NC4=C3N=CN=C4Cl)OC(=O)C)OC(=O)C

Isomeric SMILES

CCC1=CN=C(O1)C2CC(C(O2)(N3C=NC4=C3N=CN=C4Cl)OC(=O)C)OC(=O)C

InChI

InChI=1S/C18H18ClN5O6/c1-4-11-6-20-17(28-11)12-5-13(27-9(2)25)18(30-12,29-10(3)26)24-8-23-14-15(19)21-7-22-16(14)24/h6-8,12-13H,4-5H2,1-3H3