1,3-dimethyl-8-(2-oxidanyl-1-phenyl-ethyl)-7H-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-(2-oxidanyl-1-phenyl-ethyl)-7H-purine-2,6-dione Openeye Name: 8-(2-hydroxy-1-phenyl-ethyl)-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-(2-hydroxy-1-phenylethyl)-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-(2-hydroxy-1-phenylethyl)-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-(2-hydroxy-1-phenyl-ethyl)-1,3-dimethyl-7H-purine-2,6-quinone Formula: C15H16N4O3 MolecularWeight: 300.31254

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C(CO)C3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C(CO)C3=CC=CC=C3

InChI

InChI=1S/C15H16N4O3/c1-18-13-11(14(21)19(2)15(18)22)16-12(17-13)10(8-20)9-6-4-3-5-7-9/h3-7,10,20H,8H2,1-2H3,(H,16,17)