3-butyl-7-cyclopentyl-8-(4-nitrophenyl)purine-2,6-dione
Molecular Formula:
C
20
H
23
N
5
O
4
InChI:
InChI=1/C20H23N5O4/c1-2-3-12-23-18-16(19(26)22-20(23)27)24(14-6-4-5-7-14)17(21-18)13-8-10-15(11-9-13)25(28)29/h8-11,14H,2-7,12H2,1H3,(H,22,26,27)/f/h22H
InChIKey:
InChIKey=YQWXGDDNYFIRTH-QWOVJGMICR
SMILES:
CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C4CCCC4
Names:
3-butyl-7-cyclopentyl-8-(4-nitrophenyl)purine-2,6-dione
Registries:
PubChem CID 3543918
PubChem ID 4788389
