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SMILES: CC1=C(CC(=O)O)C2=NC1=Cc1c(C=C)c(C)c3C=C4N=C(C=c5n([Fe](Cl)n13)c(=C2)c(CC(=O)O)c5C)C(=C4C=C)C Canonical SMILES: C=CC1=C(C)C2=NC1=Cc1n3c(c(c1C)C=C)C=C1N=C(C=c4n(c(=C2)c(C)c4CC(=O)O)[Fe]3Cl)C(=C1C)CC(=O)O InChI: InChI=1S/C32H30N4O4.ClH.Fe/c1-7-19-15(3)23-11-24-17(5)21(9-31(37)38)29(35-24)14-30-22(10-32(39)40)18(6)26(36-30)13-28-20(8-2)16(4)25(34-28)12-27(19)33-23;;/h7-8,11-14H,1-2,9-10H2,3-6H3,(H4,33,34,35,36,37,38,39,40);1H;/q;;+3/p-3 InChIKey: MANKGYBLWAMRLW-UHFFFAOYSA-K
CBID:106061 http://www.chembase.cn/molecule-106061.html