(9-ethanoyl-6-ethanoylimino-1-methyl-purin-2-yl) ethanoate

Systemtic Name: (9-ethanoyl-6-ethanoylimino-1-methyl-purin-2-yl) ethanoate Openeye Name: (9-acetyl-6-acetylimino-1-methyl-purin-2-yl) acetate CAS Name: acetic acid (9-acetyl-6-acetylimino-1-methyl-2-purinyl) ester IUPAC Name: (9-acetyl-6-acetylimino-1-methylpurin-2-yl) acetate Traditional Name: acetic acid (9-acetyl-6-acetylimino-1-methyl-purin-2-yl) ester Formula: C12H13N5O4 MolecularWeight: 291.26272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N=C1C2=C(N=C(N1C)OC(=O)C)N(C=N2)C(=O)C

Isomeric SMILES

CC(=O)N=C1C2=C(N=C(N1C)OC(=O)C)N(C=N2)C(=O)C

InChI

InChI=1S/C12H13N5O4/c1-6(18)14-10-9-11(17(5-13-9)7(2)19)15-12(16(10)4)21-8(3)20/h5H,1-4H3