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SMILES: n1n(c(c(c1)C=O)C)CCCl Canonical SMILES: Cc1c(C=O)cnn1CCCl InChI: InChI=1S/C7H9ClN2O/c1-6-7(5-11)4-9-10(6)3-2-8/h4-5H,2-3H2,1H3 InChIKey: QPXDCNHFMCCQOT-UHFFFAOYSA-N
CBID:306778 http://www.chembase.cn/molecule-306778.html