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SMILES: c1c(c(cc(c1OC)OC)CCC#N)Br Canonical SMILES: N#CCCc1cc(OC)c(cc1Br)OC InChI: InChI=1S/C11H12BrNO2/c1-14-10-6-8(4-3-5-13)9(12)7-11(10)15-2/h6-7H,3-4H2,1-2H3 InChIKey: PKRKQYZQPMFUJG-UHFFFAOYSA-N
CBID:113066 http://www.chembase.cn/molecule-113066.html