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SMILES: [N+](=O)(c1cc(C(=O)NC(C(=O)O)CCSC)ccc1)[O-] Canonical SMILES: CSCCC(C(=O)O)NC(=O)c1cccc(c1)[N+](=O)[O-] InChI: InChI=1S/C12H14N2O5S/c1-20-6-5-10(12(16)17)13-11(15)8-3-2-4-9(7-8)14(18)19/h2-4,7,10H,5-6H2,1H3,(H,13,15)(H,16,17) InChIKey: QXXOOFQUSPEKGT-UHFFFAOYSA-N
CBID:234042 http://www.chembase.cn/molecule-234042.html