4,7-dimethyl-2-(2-oxidanylidenepropyl)purino[8,7-b][1,3]oxazole-1,3-dione

Systemtic Name: 4,7-dimethyl-2-(2-oxidanylidenepropyl)purino[8,7-b][1,3]oxazole-1,3-dione Openeye Name: 2-acetonyl-4,7-dimethyl-purino[8,7-b]oxazole-1,3-dione CAS Name: 4,7-dimethyl-2-(2-oxopropyl)purino[8,7-b]oxazole-1,3-dione IUPAC Name: 4,7-dimethyl-2-(2-oxopropyl)purino[8,7-b][1,3]oxazole-1,3-dione Traditional Name: 2-acetonyl-4,7-dimethyl-purino[8,7-b]oxazole-1,3-quinone Formula: C12H12N4O4 MolecularWeight: 276.24808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2O1)N(C(=O)N(C3=O)CC(=O)C)C

Isomeric SMILES

CC1=CN2C3=C(N=C2O1)N(C(=O)N(C3=O)CC(=O)C)C

InChI

InChI=1S/C12H12N4O4/c1-6(17)4-16-10(18)8-9(14(3)12(16)19)13-11-15(8)5-7(2)20-11/h5H,4H2,1-3H3