1-[(4-nitrophenyl)methyl]-7H-purin-6-one

Molecular Formula: C12H9N5O3


InChI: InChI=1/C12H9N5O3/c18-12-10-11(14-6-13-10)15-7-16(12)5-8-1-3-9(4-2-8)17(19)20/h1-4,6-7H,5H2,(H,13,14)/f/h13H

InChIKey: InChIKey=BLRIXZNYJMLUQG-NDKGDYFDCC
SMILES: C1=CC(=CC=C1CN2C=NC3=C(C2=O)NC=N3)[N+](=O)[O-]

Names:
    1-[(4-nitrophenyl)methyl]-7H-purin-6-one

Registries:
    PubChem CID 623161
    PubChem ID 4836792