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SMILES: c12n(c(=O)[nH]c1cccc2)C1=CCNCC1 Canonical SMILES: O=c1[nH]c2c(n1C1=CCNCC1)cccc2 InChI: InChI=1S/C12H13N3O/c16-12-14-10-3-1-2-4-11(10)15(12)9-5-7-13-8-6-9/h1-5,13H,6-8H2,(H,14,16) InChIKey: YFEOSTXFQCDCAR-UHFFFAOYSA-N
CBID:798554 http://www.chembase.cn/molecule-798554.html