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SMILES: O=C(c1cc(ccc1)Br)OC(C)(C)C Canonical SMILES: Brc1cccc(c1)C(=O)OC(C)(C)C InChI: InChI=1S/C11H13BrO2/c1-11(2,3)14-10(13)8-5-4-6-9(12)7-8/h4-7H,1-3H3 InChIKey: NPVLZVSAZXTBSR-UHFFFAOYSA-N
CBID:90993 http://www.chembase.cn/molecule-90993.html