HIT ID: HIT212710065
Cas No: 205432-12-8
分子式: C13H16N6O8
分子量: 384.305
常用名: JS-K
氢键受体数 (HBA): 9
氢键供体数 (HBD): 0
LogP: 0.007653562
IUPAC: (1Z)-2-(2,4-dinitrophenoxy)-1-[4-(ethoxycarbonyl)piperazin-1-yl]diazen-1-ium-1-olate
IUPAC: (1Z)-2-(2,4-dinitrophenoxy)-1-[4-(ethoxycarbonyl)piperazin-1-yl]diazen-1-ium-1-olate
SMILES: CCOC(=O)N1CCN(CC1)[N+](\[O-])=N\Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O
SMILES: CCOC(=O)N1CCN(CC1)[N+](\[O-])=N\Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O
InChI key: DNJRNBYZLPKSHV-RGEXLXHISA-N
