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

Systemtic Name: 1,3-dimethyl-8-(1-phenylethyl)-7H-purine-2,6-dione Openeye Name: 1,3-dimethyl-8-(1-phenylethyl)-7H-purine-2,6-dione CAS Name: 1,3-dimethyl-8-(1-phenylethyl)-7H-purine-2,6-dione IUPAC Name: 1,3-dimethyl-8-(1-phenylethyl)-7H-purine-2,6-dione Traditional Name: 1,3-dimethyl-8-(1-phenylethyl)-7H-purine-2,6-quinone Formula: C15H16N4O2 MolecularWeight: 284.31314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC(C1=CC=CC=C1)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C15H16N4O2/c1-9(10-7-5-4-6-8-10)12-16-11-13(17-12)18(2)15(21)19(3)14(11)20/h4-9H,1-3H3,(H,16,17)