Vitas-M small molecule compound

2-methoxyethyl 4-(4-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK079082
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)O)C(=O)CCC2

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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 C20H23NO5 MW 357.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO5/c1-12-17(20(24)26-11-10-25-2)18(13-6-8-14(22)9-7-13)19-15(21-12)4-3-5-16(19)23/h6-9,18,21-22H,3-5,10-11H2,1-2H3
InChIKey
PGRXLUNHDKOPDJ-UHFFFAOYSA-N
Synonyms
299452-72-5
299452725
2methoxyethyl4(4hydroxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2methoxyethyl4(4hydroxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)O)C(=O)OCCOC
COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)O)C(=O)CCC2
InChI=1SC20H23NO5c11217(20(24)261110252)18(136814(22)9713)1915(2112)43516(19)23h69182122H351011H212H3
MFCD00771131
STK079082
ZINC000002057129
ZINC000002057130

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Available files

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