3,7-dimethyl-1-(2-oxidanylidenepropyl)-9H-purine-2,6,8-trione

Systemtic Name: 3,7-dimethyl-1-(2-oxidanylidenepropyl)-9H-purine-2,6,8-trione Openeye Name: 1-acetonyl-3,7-dimethyl-9H-purine-2,6,8-trione CAS Name: 3,7-dimethyl-1-(2-oxopropyl)-9H-purine-2,6,8-trione IUPAC Name: 3,7-dimethyl-1-(2-oxopropyl)-9H-purine-2,6,8-trione Traditional Name: 1-acetonyl-3,7-dimethyl-9H-purine-2,6,8-trione Formula: C10H12N4O4 MolecularWeight: 252.22668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C(=O)C2=C(NC(=O)N2C)N(C1=O)C

Isomeric SMILES

CC(=O)CN1C(=O)C2=C(NC(=O)N2C)N(C1=O)C

InChI

InChI=1S/C10H12N4O4/c1-5(15)4-14-8(16)6-7(13(3)10(14)18)11-9(17)12(6)2/h4H2,1-3H3,(H,11,17)