1,3-dimethyl-8-(2-methylphenyl)-7H-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-(2-methylphenyl)-7H-purine-2,6-dione Openeye Name: 1,3-dimethyl-8-(o-tolyl)-7H-purine-2,6-dione CAS Name: 1,3-dimethyl-8-(2-methylphenyl)-7H-purine-2,6-dione IUPAC Name: 1,3-dimethyl-8-(2-methylphenyl)-7H-purine-2,6-dione Traditional Name: 1,3-dimethyl-8-(o-tolyl)-7H-purine-2,6-quinone Formula: C14H14N4O2 MolecularWeight: 270.28656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(N2)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(N2)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C14H14N4O2/c1-8-6-4-5-7-9(8)11-15-10-12(16-11)17(2)14(20)18(3)13(10)19/h4-7H,1-3H3,(H,15,16)