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SMILES: n1cnn(c1)CCCC(=O)O Canonical SMILES: OC(=O)CCCn1cncn1 InChI: InChI=1S/C6H9N3O2/c10-6(11)2-1-3-9-5-7-4-8-9/h4-5H,1-3H2,(H,10,11) InChIKey: CHXJINAQOAKBSQ-UHFFFAOYSA-N
CBID:16142 http://www.chembase.cn/molecule-16142.html