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SMILES: n1nncn1c1c(cc(cc1)Cl)C=O Canonical SMILES: O=Cc1cc(Cl)ccc1n1cnnn1 InChI: InChI=1S/C8H5ClN4O/c9-7-1-2-8(6(3-7)4-14)13-5-10-11-12-13/h1-5H InChIKey: JYIIRAPFQHKOOC-UHFFFAOYSA-N
CBID:80361 http://www.chembase.cn/molecule-80361.html