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SMILES: Cl.C1Cc2c(C(=O)C1)ccnc2 Canonical SMILES: O=C1CCCc2c1ccnc2.Cl InChI: InChI=1S/C9H9NO.ClH/c11-9-3-1-2-7-6-10-5-4-8(7)9;/h4-6H,1-3H2;1H InChIKey: XIFLOZYAKQKYHN-UHFFFAOYSA-N
CBID:799264 http://www.chembase.cn/molecule-799264.html