3-methyl-8-(phenylmethyl)-7H-purine-2,6-dione

Systemtic Name: 3-methyl-8-(phenylmethyl)-7H-purine-2,6-dione Openeye Name: 8-benzyl-3-methyl-7H-purine-2,6-dione CAS Name: 3-methyl-8-(phenylmethyl)-7H-purine-2,6-dione IUPAC Name: 8-benzyl-3-methyl-7H-purine-2,6-dione Traditional Name: 8-benzyl-3-methyl-7H-purine-2,6-quinone Formula: C13H12N4O2 MolecularWeight: 256.25998

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)NC(=N2)CC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)NC(=N2)CC3=CC=CC=C3

InChI

InChI=1S/C13H12N4O2/c1-17-11-10(12(18)16-13(17)19)14-9(15-11)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,14,15)(H,16,18,19)