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SMILES: [Ca+2].Cc1c(N)c(cc(c1)/C(=C/1\C=CC(=N)C(=C1)S(=O)(=O)O)/c1cc(c(N)cc1)S(=O)(=O)[O-])S(=O)(=O)[O-] Canonical SMILES: Cc1cc(cc(c1N)S(=O)(=O)[O-])/C(=C/1\C=CC(=N)C(=C1)S(=O)(=O)O)/c1ccc(c(c1)S(=O)(=O)[O-])N.[Ca+2] InChI: InChI=1S/C20H19N3O9S3.Ca/c1-10-6-13(9-18(20(10)23)35(30,31)32)19(11-2-4-14(21)16(7-11)33(24,25)26)12-3-5-15(22)17(8-12)34(27,28)29;/h2-9,21H,22-23H2,1H3,(H,24,25,26)(H,27,28,29)(H,30,31,32);/q;+2/p-2 InChIKey: SVIISRNRODSEHG-UHFFFAOYSA-L
CBID:103684 http://www.chembase.cn/molecule-103684.html