HIT ID: HIT212035606
Cas No: 113104-25-9
分子式: C11H6N4O4S
分子量: 290.25
常用名: NSC 228155
氢键受体数 (HBA): 5
氢键供体数 (HBD): 0
LogP: 1.17
IUPAC: 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)sulfanyl]pyridin-1-ium-1-olate
IUPAC: 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)sulfanyl]pyridin-1-ium-1-olate
SMILES: [O-][N+](=O)c1ccc(Sc2cccc[n+]2[O-])c2nonc12
SMILES: [O-][N+](=O)c1ccc(Sc2cccc[n+]2[O-])c2nonc12
InChI key: ICCFXXDUYSPKOL-UHFFFAOYSA-N
