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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C(=O)NC1=O)NC=N2

Isomeric SMILES

CCOC(=O)CN1C2=C(C(=O)NC1=O)NC=N2

InChI

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