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SMILES: N1(c2cc(C=O)ccc2)CCCCC1 Canonical SMILES: O=Cc1cccc(c1)N1CCCCC1 InChI: InChI=1S/C12H15NO/c14-10-11-5-4-6-12(9-11)13-7-2-1-3-8-13/h4-6,9-10H,1-3,7-8H2 InChIKey: FXXQUTSXXILOMY-UHFFFAOYSA-N
CBID:101199 http://www.chembase.cn/molecule-101199.html