提示: 按住Ctrl键可以同时选择多个官能团
SMILES: C[N+](C)(C)CCCOc1ccc(cc1)/C/1=C\2/N=C(/C=c/3\[nH]/c(=C(\C4=N/C(=C\c5ccc1[nH]5)/C=C4)/c1ccc(OCCC[N+](C)(C)C)cc1)/cc3)C=C2.[Cl-].[Cl-] Canonical SMILES: C[N+](CCCOc1ccc(cc1)/C/1=C/2\C=CC(=N2)/C=c\2/cc/c(=C(/C3=N/C(=C\c4[nH]c1cc4)/C=C3)\c1ccc(cc1)OCCC[N+](C)(C)C)/[nH]2)(C)C.[Cl-].[Cl-] InChI: InChI=1S/C44H50N6O2.2ClH/c1-49(2,3)25-7-27-51-37-17-9-31(10-18-37)43-39-21-13-33(45-39)29-35-15-23-41(47-35)44(42-24-16-36(48-42)30-34-14-22-40(43)46-34)32-11-19-38(20-12-32)52-28-8-26-50(4,5)6;;/h9-24,29-30,45,48H,7-8,25-28H2,1-6H3;2*1H/q+2;;/p-2/b33-29-,34-30-,35-29-,36-30-,43-39-,43-40-,44-41-,44-42-;; InChIKey: KJLHJQGDBJNMPU-XRFOENPRSA-L
CBID:130464 http://www.chembase.cn/molecule-130464.html