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

Systemtic Name: [3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl] ethanoate Openeye Name: (3,7-dimethyl-2,6-dioxo-purin-1-yl) acetate CAS Name: acetic acid (3,7-dimethyl-2,6-dioxo-1-purinyl) ester IUPAC Name: (3,7-dimethyl-2,6-dioxopurin-1-yl) acetate Traditional Name: acetic acid (2,6-diketo-3,7-dimethyl-purin-1-yl) ester Formula: C9H10N4O4 MolecularWeight: 238.2001

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON1C(=O)C2=C(N=CN2C)N(C1=O)C

Isomeric SMILES

CC(=O)ON1C(=O)C2=C(N=CN2C)N(C1=O)C

InChI

InChI=1S/C9H10N4O4/c1-5(14)17-13-8(15)6-7(10-4-11(6)2)12(3)9(13)16/h4H,1-3H3