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SMILES: c1c(c(cc(c1)C=O)[N+](=O)[O-])SC1CCCCC1 Canonical SMILES: O=Cc1ccc(c(c1)[N+](=O)[O-])SC1CCCCC1 InChI: InChI=1S/C13H15NO3S/c15-9-10-6-7-13(12(8-10)14(16)17)18-11-4-2-1-3-5-11/h6-9,11H,1-5H2 InChIKey: SXIMCYMJTYWOMN-UHFFFAOYSA-N
CBID:44261 http://www.chembase.cn/molecule-44261.html