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SMILES: C1CNCC=C1c1c2[nH]c(=O)ccc2[nH]c1 Canonical SMILES: O=c1ccc2c([nH]1)c(c[nH]2)C1=CCNCC1 InChI: InChI=1S/C12H13N3O/c16-11-2-1-10-12(15-11)9(7-14-10)8-3-5-13-6-4-8/h1-3,7,13-14H,4-6H2,(H,15,16) InChIKey: PJYVGMRFPFNZCT-UHFFFAOYSA-N
CBID:126734 http://www.chembase.cn/molecule-126734.html