[(2R,3R,4R,5R)-3,4-diacetyloxy-5-[2-[2-(benzimidazol-1-yl)ethoxy]-6-chloranyl-purin-9-yl]oxolan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,4R,5R)-3,4-diacetyloxy-5-[2-[2-(benzimidazol-1-yl)ethoxy]-6-chloranyl-purin-9-yl]oxolan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4R,5R)-3,4-diacetoxy-5-[2-[2-(benzimidazol-1-yl)ethoxy]-6-chloro-purin-9-yl]tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4R,5R)-3,4-diacetyloxy-5-[2-[2-(1-benzimidazolyl)ethoxy]-6-chloro-9-purinyl]-2-oxolanyl]methyl ester IUPAC Name: [(2R,3R,4R,5R)-3,4-diacetyloxy-5-[2-[2-(benzimidazol-1-yl)ethoxy]-6-chloropurin-9-yl]oxolan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4R,5R)-3,4-diacetoxy-5-[2-[2-(benzimidazol-1-yl)ethoxy]-6-chloro-purin-9-yl]tetrahydrofuran-2-yl]methyl ester Formula: C25H25ClN6O8 MolecularWeight: 572.9544

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=C(N=C3Cl)OCCN4C=NC5=CC=CC=C54)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=C(N=C3Cl)OCCN4C=NC5=CC=CC=C54)OC(=O)C)OC(=O)C

InChI

InChI=1S/C25H25ClN6O8/c1-13(33)37-10-18-20(38-14(2)34)21(39-15(3)35)24(40-18)32-12-28-19-22(26)29-25(30-23(19)32)36-9-8-31-11-27-16-6-4-5-7-17(16)31/h4-7,11-12,18,20-21,24H,8-10H2,1-3H3/t18-,20-,21-,24-/m1/s1