methyl 2-(2-acetamido-6-oxidanylidene-3H-purin-7-yl)ethanoate

Systemtic Name: methyl 2-(2-acetamido-6-oxidanylidene-3H-purin-7-yl)ethanoate Openeye Name: methyl 2-(2-acetamido-6-oxo-3H-purin-7-yl)acetate CAS Name: 2-(2-acetamido-6-oxo-3H-purin-7-yl)acetic acid methyl ester IUPAC Name: methyl 2-(2-acetamido-6-oxo-3H-purin-7-yl)acetate Traditional Name: 2-(2-acetamido-6-keto-3H-purin-7-yl)acetic acid methyl ester Formula: C10H11N5O4 MolecularWeight: 265.22544

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=O)C2=C(N1)N=CN2CC(=O)OC

Isomeric SMILES

CC(=O)NC1=NC(=O)C2=C(N1)N=CN2CC(=O)OC

InChI

InChI=1S/C10H11N5O4/c1-5(16)12-10-13-8-7(9(18)14-10)15(4-11-8)3-6(17)19-2/h4H,3H2,1-2H3,(H2,12,13,14,16,18)