Vitas-M small molecule compound

ethyl 1-{[3-(ethoxycarbonyl)-5-hydroxy-1-benzofuran-2-yl]methyl}piperidine-4-carboxylate

Catalog ID
STK689094
SMILES CCOC(=O)C1CCN(CC1)Cc1oc2c(c1C(=O)OCC)cc(cc2)O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H25NO6 MW 375.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO6/c1-3-25-19(23)13-7-9-21(10-8-13)12-17-18(20(24)26-4-2)15-11-14(22)5-6-16(15)27-17/h5-6,11,13,22H,3-4,7-10,12H2,1-2H3
InChIKey
UACPSBJFQHKKGU-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1CCN(CC1)CC2=C(C3=C(O2)C=CC(=C3)O)C(=O)OCC
ethyl1((3(ethoxycarbonyl)5hydroxy1benzofuran2yl)methyl)piperidine4carboxylate
ETHYL1((3ETHOXYCARBONYL5HYDROXY1BENZOFURAN2YL)METHYL)PIPERIDINE4CARBOXYLATE
InChI=1SC20H25NO6c132519(23)137921(10813)121718(20(24)2642)151114(22)5616(15)2717h56111322H3471012H212H3
MFCD07800366
ZINC000004786617
ZINC4786617

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.