1-butyl-3-phenyl-7H-purine-2,6-dione

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(N=CN2)N(C1=O)C3=CC=CC=C3

Isomeric SMILES

CCCCN1C(=O)C2=C(N=CN2)N(C1=O)C3=CC=CC=C3

InChI

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