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SMILES: O=C(c1c(c(ccc1)N)NCCN)O Canonical SMILES: NCCNc1c(N)cccc1C(=O)O InChI: InChI=1S/C9H13N3O2/c10-4-5-12-8-6(9(13)14)2-1-3-7(8)11/h1-3,12H,4-5,10-11H2,(H,13,14) InChIKey: SWSKNWWEQFLJIL-UHFFFAOYSA-N
CBID:73435 http://www.chembase.cn/molecule-73435.html