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SMILES: COC(=O)CCc1c(C)/c/2=C/C3=N/C(=C/c4c(C)c(C=C)c([nH]4)/C=C/4\N=C(/C=c/1\[nH]2)C(=C4C)CCC(=O)OC)/C(=C3C)C=C Canonical SMILES: COC(=O)CCc1/c/2=C/C3=N/C(=C\c4[nH]c(/C=C\5/N=C(/C=c(/c1C)\[nH]2)C(=C5C=C)C)c(c4C=C)C)/C(=C3CCC(=O)OC)C InChI: InChI=1S/C36H38N4O4/c1-9-23-19(3)27-15-28-21(5)25(11-13-35(41)43-7)33(39-28)18-34-26(12-14-36(42)44-8)22(6)30(40-34)17-32-24(10-2)20(4)29(38-32)16-31(23)37-27/h9-10,15-18,38-39H,1-2,11-14H2,3-8H3/b27-15+,28-15-,29-16-,30-17-,31-16+,32-17-,33-18-,34-18- InChIKey: XNCGCBXDDMJCKW-ZZUNGSQTSA-N
CBID:111153 http://www.chembase.cn/molecule-111153.html