2-[[6-(4-acetamidophenyl)-9-oxidanylidene-5H-imidazo[1,2-a]purin-3-yl]methoxy]ethyl ethanoate

Systemtic Name: 2-[[6-(4-acetamidophenyl)-9-oxidanylidene-5H-imidazo[1,2-a]purin-3-yl]methoxy]ethyl ethanoate Openeye Name: 2-[[6-(4-acetamidophenyl)-9-oxo-5H-imidazo[1,2-a]purin-3-yl]methoxy]ethyl acetate CAS Name: acetic acid 2-[[6-(4-acetamidophenyl)-9-oxo-5H-imidazo[1,2-a]purin-3-yl]methoxy]ethyl ester IUPAC Name: 2-[[6-(4-acetamidophenyl)-9-oxo-5H-imidazo[1,2-a]purin-3-yl]methoxy]ethyl acetate Traditional Name: acetic acid 2-[[6-(4-acetamidophenyl)-9-keto-5H-imidazo[1,2-a]purin-3-yl]methoxy]ethyl ester Formula: C20H20N6O5 MolecularWeight: 424.41

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=CN3C(=O)C4=C(N=C3N2)N(C=N4)COCCOC(=O)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=CN3C(=O)C4=C(N=C3N2)N(C=N4)COCCOC(=O)C

InChI

InChI=1S/C20H20N6O5/c1-12(27)22-15-5-3-14(4-6-15)16-9-26-19(29)17-18(24-20(26)23-16)25(10-21-17)11-30-7-8-31-13(2)28/h3-6,9-10H,7-8,11H2,1-2H3,(H,22,27)(H,23,24)