Vitas-M small molecule compound

ethyl 6-(3-methoxyphenyl)-4-(morpholin-4-yl)-2-oxocyclohex-3-ene-1-carboxylate

Catalog ID
STK682583
SMILES CCOC(=O)C1C(=O)C=C(CC1c1cccc(c1)OC)N1CCOCC1

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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 C20H25NO5 MW 359.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO5/c1-3-26-20(23)19-17(14-5-4-6-16(11-14)24-2)12-15(13-18(19)22)21-7-9-25-10-8-21/h4-6,11,13,17,19H,3,7-10,12H2,1-2H3
InChIKey
NXVBLOXYDZFGOT-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1C(CC(=CC1=O)N2CCOCC2)C3=CC(=CC=C3)OC
ETHYL(1S6S)6(3METHOXYPHENYL)4(MORPHOLIN4YL)2OXOCYCLOHEX3ENE1CARBOXYLATE
ethyl6(3methoxyphenyl)4(morpholin4yl)2oxocyclohex3ene1carboxylate
ETHYL6(3METHOXYPHENYL)4MORPHOLIN4YL2OXOCYCLOHEX3ENE1CARBOXYLATE
InChI=1SC20H25NO5c132620(23)1917(1454616(1114)242)1215(1318(19)22)21792510821h4611131719H371012H212H3
MFCD03856133
ZINC000001440881
ZINC000001440884

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Available files

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