名称: 1,3-Di-n-butyl-8-nitro xanthine

IUPAC: 1,3-dibutyl-8-nitro-7H-purine-2,6-dione

SMILES: CCCCn1c(=O)c2[nH]c([N+](=O)[O-])nc2n(CCCC)c1=O

Canonical SMILES: CCCCN1C2=C(C(=O)N(C1=O)CCCC)NC(=N2)[N+](=O)[O-]

分子式: C13H19N5O4

分子量: 309.32

InChIKey: PEUMRAZSOJOADF-UHFFFAOYSA-N

InChI: InChI=1S/C13H19N5O4/c1-3-5-7-16-10-9(14-12(15-10)18(21)22)11(19)17(13(16)20)8-6-4-2/h3-8H2,1-2H3,(H,14,15)

同義語

SCHEMBL7026735PEUMRAZSOJOADF-UHFFFAOYSA-N1,3-Di-n-butyl-8-nitro Xanthine

拡張検索