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SMILES: c1ccc2c(c1)c1c([nH]2)[C@H]2N(CC1)C/C(=C/C)/[C@H](C2)[C@H](Cc1c2c(c3[n+](c1)C[C@H]1[C@H](C3)C(=CO[C@H]1C)C(=O)OC)[n-]c1c2cccc1)C(=O)OC Canonical SMILES: COC(=O)[C@H]([C@H]1C[C@@H]2N(C/C/1=C/C)CCc1c2[nH]c2c1cccc2)Cc1c[n+]2C[C@@H]3[C@H](C)OC=C([C@H]3Cc2c2c1c1ccccc1[n-]2)C(=O)OC InChI: InChI=1S/C42H44N4O5/c1-5-24-19-45-15-14-27-26-10-6-8-12-34(26)43-39(27)36(45)17-29(24)31(41(47)49-3)16-25-20-46-21-32-23(2)51-22-33(42(48)50-4)30(32)18-37(46)40-38(25)28-11-7-9-13-35(28)44-40/h5-13,20,22-23,29-32,36,43H,14-19,21H2,1-4H3/b24-5-/t23-,29-,30-,31-,32+,36-/m0/s1 InChIKey: QWAUBSSAJRGKPX-XKMAVODYSA-N
CBID:304413 http://www.chembase.cn/molecule-304413.html