methyl 4-[(6-oxo-3H-purin-9-yl)methyl]benzoate
Molecular Formula:
C
14
H
12
N
4
O
3
InChI:
InChI=1/C14H12N4O3/c1-21-14(20)10-4-2-9(3-5-10)6-18-8-17-11-12(18)15-7-16-13(11)19/h2-5,7-8H,6H2,1H3,(H,15,16,19)/f/h15H
InChIKey:
InChIKey=JWCBZLXTLJALKK-YAQRNVERCM
SMILES:
COC(=O)C1=CC=C(C=C1)CN2C=NC3=C2NC=NC3=O
Names:
methyl 4-[(6-oxo-3H-purin-9-yl)methyl]benzoate
NSC212228
92150-24-8
Registries:
PubChem CID 309793
PubChem ID 127549