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SMILES: c1(n(nc2c1CCCC2)C)C(=O)O Canonical SMILES: OC(=O)c1n(C)nc2c1CCCC2 InChI: InChI=1S/C9H12N2O2/c1-11-8(9(12)13)6-4-2-3-5-7(6)10-11/h2-5H2,1H3,(H,12,13) InChIKey: JPFHYMMFZMXFMY-UHFFFAOYSA-N
CBID:18109 http://www.chembase.cn/molecule-18109.html