Vitas-M small molecule compound

methyl 4-{5-[(4-methoxyphenoxy)methyl]furan-2-yl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK961455
SMILES COc1ccc(cc1)OCc1ccc(o1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC

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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 C24H25NO6 MW 423.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO6/c1-14-21(24(27)29-3)23(22-18(25-14)5-4-6-19(22)26)20-12-11-17(31-20)13-30-16-9-7-15(28-2)8-10-16/h7-12,23,25H,4-6,13H2,1-3H3
InChIKey
CIAPRBFDUKDENW-UHFFFAOYSA-N
Synonyms
445236-86-2
445236862
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(O3)COC4=CC=C(C=C4)OC)C(=O)OC
InChI=1SC24H25NO6c11421(24(27)293)23(2218(2514)54619(22)26)20121117(3120)1330169715(282)81016h7122325H4613H213H3
methyl4(5((4methoxyphenoxy)methyl)furan2yl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(5((4methoxyphenoxy)methyl)furan2yl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD02374129
ZINC000000649388
ZINC000000649392

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Available files

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