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SMILES: N1(c2ncc(cn2)C=O)CCCC1 Canonical SMILES: O=Cc1cnc(nc1)N1CCCC1 InChI: InChI=1S/C9H11N3O/c13-7-8-5-10-9(11-6-8)12-3-1-2-4-12/h5-7H,1-4H2 InChIKey: KJMKROLYLRRJDN-UHFFFAOYSA-N
CBID:77510 http://www.chembase.cn/molecule-77510.html