9-(4-methylpentan-2-yl)-3,7-dihydropurine-2,8-dione

Systemtic Name: 9-(4-methylpentan-2-yl)-3,7-dihydropurine-2,8-dione Openeye Name: 9-(1,3-dimethylbutyl)-3,7-dihydropurine-2,8-dione CAS Name: 9-(4-methylpentan-2-yl)-3,7-dihydropurine-2,8-dione IUPAC Name: 9-(4-methylpentan-2-yl)-3,7-dihydropurine-2,8-dione Traditional Name: 9-(1,3-dimethylbutyl)-3,7-dihydropurine-2,8-quinone Formula: C11H16N4O2 MolecularWeight: 236.27034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)N1C2=C(C=NC(=O)N2)NC1=O

Isomeric SMILES

CC(C)CC(C)N1C2=C(C=NC(=O)N2)NC1=O

InChI

InChI=1S/C11H16N4O2/c1-6(2)4-7(3)15-9-8(13-11(15)17)5-12-10(16)14-9/h5-7H,4H2,1-3H3,(H,13,17)(H,12,14,16)