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SMILES: COc1ccc(cc1)C1C2NC(C(c3n4c(C(C5NC(C(c6n(c1cc6)[Fe]4Cl)c1ccc(cc1)OC)C=C5)c1ccc(cc1)OC)cc3)c1ccc(cc1)OC)C=C2 Canonical SMILES: COc1ccc(cc1)C1C2C=CC(N2)C(c2ccc(cc2)OC)c2n3[Fe](n4c1ccc4C(C1C=CC(N1)C(c3cc2)c1ccc(cc1)OC)c1ccc(cc1)OC)Cl InChI: InChI=1S/C48H46N4O4.ClH.Fe/c1-53-33-13-5-29(6-14-33)45-37-21-23-39(49-37)46(30-7-15-34(54-2)16-8-30)41-25-27-43(51-41)48(32-11-19-36(56-4)20-12-32)44-28-26-42(52-44)47(40-24-22-38(45)50-40)31-9-17-35(55-3)18-10-31;;/h5-28,37,39,42,44-49,52H,1-4H3;1H;/q-2;;+3/p-1 InChIKey: UUMBFHXWACWQRZ-UHFFFAOYSA-M
CBID:139931 http://www.chembase.cn/molecule-139931.html