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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10N4O4/c1-12-7-6(10-4-11-7)8(15)13(9(12)16)3-5(14)17-2/h4H,3H2,1-2H3,(H,10,11)