basic_info |
|
| Product_Name: | 2-[(OXAN-4-YLMETHYL)SULFANYL]BENZOIC ACID |
| EnglishSynonyms: | 2-[(OXAN-4-YLMETHYL)SULFANYL]BENZOIC ACID |
| pro_mdlNumber: | MFCD17063222 |
| pro_acceptors: | 3 |
| pro_donors: | 1 |
| pro_smile: | c1ccc(c(c1)C(=O)O)SCC2CCOCC2 |
| InChi: | InChI=1S/C13H16O3S/c14-13(15)11-3-1-2-4-12(11)17-9-10-5-7-16-8-6-10/h1-4,10H,5-9H2,(H,14,15) |
| InChiKey: | InChIKey=VWJMLSIFWMQKAT-UHFFFAOYSA-N |
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