methyl 2-[8-bromanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoate

Systemtic Name: methyl 2-[8-bromanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoate Openeye Name: methyl 2-(8-bromo-1,3-dimethyl-2,6-dioxo-purin-7-yl)acetate CAS Name: 2-(8-bromo-1,3-dimethyl-2,6-dioxo-7-purinyl)acetic acid methyl ester IUPAC Name: methyl 2-(8-bromo-1,3-dimethyl-2,6-dioxopurin-7-yl)acetate Traditional Name: 2-(8-bromo-2,6-diketo-1,3-dimethyl-purin-7-yl)acetic acid methyl ester Formula: C10H11BrN4O4 MolecularWeight: 331.12274

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Br)CC(=O)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Br)CC(=O)OC

InChI

InChI=1S/C10H11BrN4O4/c1-13-7-6(8(17)14(2)10(13)18)15(9(11)12-7)4-5(16)19-3/h4H2,1-3H3