![4-[(Chlorosulfonyl)methyl]-1-piperidinecarboxylic Acid Phenylmethyl Ester](https://resource.bocsci.com/structure/1211587-42-6.gif)
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| IUPAC Name: | benzyl 4-(chlorosulfonylmethyl)piperidine-1-carboxylate |
| Description: | 4-[(Chlorosulfonyl)methyl]-1-piperidinecarboxylic Acid Phenylmethyl Ester is an intermediate used in the synthesis of EPZ031686, the first orally bioavailable small molecule SMYD3 inhibitor. |
| Molecular Weight: | 331.82 |
| Molecular Formula: | C14H18ClNO4S |
| Canonical SMILES: | C1CN(CCC1CS(=O)(=O)Cl)C(=O)OCC2=CC=CC=C2 |
| InChI: | InChI=1S/C14H18ClNO4S/c15-21(18,19)11-13-6-8-16(9-7-13)14(17)20-10-12-4-2-1-3-5-12/h1-5,13H,6-11H2 |
| InChI Key: | JOQRDARBUIIJCV-UHFFFAOYSA-N |
| References: | Mitchell, L., et al. ACS Med. Chem. Lett. (2015). |
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