1-methyl-3-(2-methylpropanoyl)-7H-purine-2,6-dione

Systemtic Name: 1-methyl-3-(2-methylpropanoyl)-7H-purine-2,6-dione Openeye Name: 1-methyl-3-(2-methylpropanoyl)-7H-purine-2,6-dione CAS Name: 1-methyl-3-(2-methyl-1-oxopropyl)-7H-purine-2,6-dione IUPAC Name: 1-methyl-3-(2-methylpropanoyl)-7H-purine-2,6-dione Traditional Name: 3-isobutyryl-1-methyl-7H-purine-2,6-quinone Formula: C10H12N4O3 MolecularWeight: 236.22728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1C2=C(C(=O)N(C1=O)C)NC=N2

Isomeric SMILES

CC(C)C(=O)N1C2=C(C(=O)N(C1=O)C)NC=N2

InChI

InChI=1S/C10H12N4O3/c1-5(2)8(15)14-7-6(11-4-12-7)9(16)13(3)10(14)17/h4-5H,1-3H3,(H,11,12)