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SMILES: n1([nH]c(=O)ccc1=O)CCC(=O)O Canonical SMILES: OC(=O)CCn1[nH]c(=O)ccc1=O InChI: InChI=1S/C7H8N2O4/c10-5-1-2-6(11)9(8-5)4-3-7(12)13/h1-2H,3-4H2,(H,8,10)(H,12,13) InChIKey: PJMGVDKZHXIURV-UHFFFAOYSA-N
CBID:113713 http://www.chembase.cn/molecule-113713.html