N-[9-[5-[2-(4-nitrophenyl)-1-oxidanyl-2-oxidanylidene-ethyl]-4-oxidanyl-oxolan-2-yl]purin-6-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[9-[5-[2-(4-nitrophenyl)-1-oxidanyl-2-oxidanylidene-ethyl]-4-oxidanyl-oxolan-2-yl]purin-6-yl]-2-phenoxy-ethanamide Openeye Name: N-[9-[4-hydroxy-5-[1-hydroxy-2-(4-nitrophenyl)-2-oxo-ethyl]tetrahydrofuran-2-yl]purin-6-yl]-2-phenoxy-acetamide CAS Name: N-[9-[4-hydroxy-5-[1-hydroxy-2-(4-nitrophenyl)-2-oxoethyl]-2-oxolanyl]-6-purinyl]-2-phenoxyacetamide IUPAC Name: N-[9-[4-hydroxy-5-[1-hydroxy-2-(4-nitrophenyl)-2-oxoethyl]oxolan-2-yl]purin-6-yl]-2-phenoxyacetamide Traditional Name: N-[9-[4-hydroxy-5-[1-hydroxy-2-keto-2-(4-nitrophenyl)ethyl]tetrahydrofuran-2-yl]purin-6-yl]-2-phenoxy-acetamide Formula: C25H22N6O8 MolecularWeight: 534.47758

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3NC(=O)COC4=CC=CC=C4)C(C(=O)C5=CC=C(C=C5)[N+](=O)[O-])O)O

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2N=CN=C3NC(=O)COC4=CC=CC=C4)C(C(=O)C5=CC=C(C=C5)[N+](=O)[O-])O)O

InChI

InChI=1S/C25H22N6O8/c32-17-10-19(39-23(17)22(35)21(34)14-6-8-15(9-7-14)31(36)37)30-13-28-20-24(26-12-27-25(20)30)29-18(33)11-38-16-4-2-1-3-5-16/h1-9,12-13,17,19,22-23,32,35H,10-11H2,(H,26,27,29,33)