butyl 2-[3-methyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoate

Systemtic Name: butyl 2-[3-methyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoate Openeye Name: butyl 2-(3-methyl-2,6-dioxo-purin-7-yl)acetate CAS Name: 2-(3-methyl-2,6-dioxo-7-purinyl)acetic acid butyl ester IUPAC Name: butyl 2-(3-methyl-2,6-dioxopurin-7-yl)acetate Traditional Name: 2-(2,6-diketo-3-methyl-purin-7-yl)acetic acid butyl ester Formula: C12H16N4O4 MolecularWeight: 280.27984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CN1C=NC2=C1C(=O)NC(=O)N2C

Isomeric SMILES

CCCCOC(=O)CN1C=NC2=C1C(=O)NC(=O)N2C

InChI

InChI=1S/C12H16N4O4/c1-3-4-5-20-8(17)6-16-7-13-10-9(16)11(18)14-12(19)15(10)2/h7H,3-6H2,1-2H3,(H,14,18,19)