HIT ID: HIT218847643
Cas No: 42783-06-2
分子式: C18H19N5O8S
分子量: 465.44
常用名: C.I. Disperse blue 284
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-{[2-(acetyloxy)ethyl]({4-[(1E)-2-(3,5-dinitrothiophen-2-yl)diazen-1-yl]phenyl})amino}ethyl acetate
IUPAC: 2-{[2-(acetyloxy)ethyl]({4-[(1E)-2-(3,5-dinitrothiophen-2-yl)diazen-1-yl]phenyl})amino}ethyl acetate
SMILES: CC(=O)OCCN(CCOC(C)=O)c1ccc(cc1)\N=N\c1sc(cc1[N+]([O-])=O)[N+]([O-])=O
SMILES: CC(=O)OCCN(CCOC(C)=O)c1ccc(cc1)\N=N\c1sc(cc1[N+]([O-])=O)[N+]([O-])=O
InChI key: YPNBSXJSFUWYMV-FMQUCBEESA-N