1-methyl-3-phenyl-8-propyl-7H-purine-2,6-dione

Systemtic Name: 1-methyl-3-phenyl-8-propyl-7H-purine-2,6-dione Openeye Name: 1-methyl-3-phenyl-8-propyl-7H-purine-2,6-dione CAS Name: 1-methyl-3-phenyl-8-propyl-7H-purine-2,6-dione IUPAC Name: 1-methyl-3-phenyl-8-propyl-7H-purine-2,6-dione Traditional Name: 1-methyl-3-phenyl-8-propyl-7H-purine-2,6-quinone Formula: C15H16N4O2 MolecularWeight: 284.31314

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1)C(=O)N(C(=O)N2C3=CC=CC=C3)C

Isomeric SMILES

CCCC1=NC2=C(N1)C(=O)N(C(=O)N2C3=CC=CC=C3)C

InChI

InChI=1S/C15H16N4O2/c1-3-7-11-16-12-13(17-11)19(10-8-5-4-6-9-10)15(21)18(2)14(12)20/h4-6,8-9H,3,7H2,1-2H3,(H,16,17)