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SMILES: C1(CCCCO1)CC(=O)O Canonical SMILES: OC(=O)CC1CCCCO1 InChI: InChI=1S/C7H12O3/c8-7(9)5-6-3-1-2-4-10-6/h6H,1-5H2,(H,8,9) InChIKey: WRJWKHJGSNPGND-UHFFFAOYSA-N
CBID:17122 http://www.chembase.cn/molecule-17122.html