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SMILES: c1(cc(n2cnnc2)ccc1Cl)C(=O)O Canonical SMILES: OC(=O)c1cc(ccc1Cl)n1cnnc1 InChI: InChI=1S/C9H6ClN3O2/c10-8-2-1-6(3-7(8)9(14)15)13-4-11-12-5-13/h1-5H,(H,14,15) InChIKey: MYPYOBGBVHWJOE-UHFFFAOYSA-N
CBID:17569 http://www.chembase.cn/molecule-17569.html