1-(2-methylpropyl)-3-phenyl-7H-purine-2,6-dione

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(N=CN2)N(C1=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C(=O)C2=C(N=CN2)N(C1=O)C3=CC=CC=C3

InChI

InChI=1S/C15H16N4O2/c1-10(2)8-18-14(20)12-13(17-9-16-12)19(15(18)21)11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,16,17)