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SMILES: C(=O)(c1cc(ncc1)NCCN)O Canonical SMILES: NCCNc1cc(ccn1)C(=O)O InChI: InChI=1S/C8H11N3O2/c9-2-4-11-7-5-6(8(12)13)1-3-10-7/h1,3,5H,2,4,9H2,(H,10,11)(H,12,13) InChIKey: WQHDTYZYNBRREF-UHFFFAOYSA-N
CBID:263407 http://www.chembase.cn/molecule-263407.html