dibenzofuran-2-yl 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoate

Systemtic Name: dibenzofuran-2-yl 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoate Openeye Name: dibenzofuran-2-yl 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetate CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)acetic acid 2-dibenzofuranyl ester IUPAC Name: dibenzofuran-2-yl 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetate Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetic acid dibenzofuran-2-yl ester Formula: C21H16N4O5 MolecularWeight: 404.37554

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)OC3=CC4=C(C=C3)OC5=CC=CC=C54

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)OC3=CC4=C(C=C3)OC5=CC=CC=C54

InChI

InChI=1S/C21H16N4O5/c1-23-19-18(20(27)24(2)21(23)28)25(11-22-19)10-17(26)29-12-7-8-16-14(9-12)13-5-3-4-6-15(13)30-16/h3-9,11H,10H2,1-2H3