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SMILES: n1(c(ncc1)C)CCCC(=O)O Canonical SMILES: OC(=O)CCCn1ccnc1C InChI: InChI=1S/C8H12N2O2/c1-7-9-4-6-10(7)5-2-3-8(11)12/h4,6H,2-3,5H2,1H3,(H,11,12) InChIKey: ILAKRGWTYGOVOH-UHFFFAOYSA-N
CBID:17896 http://www.chembase.cn/molecule-17896.html