Vitas-M small molecule compound

propyl 4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK372381
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCC)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 C23H29NO5 MW 399.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO5/c1-5-12-29-23(26)20-14(3)24-16-8-7-9-17(25)22(16)21(20)15-10-11-18(28-6-2)19(13-15)27-4/h10-11,13,21,24H,5-9,12H2,1-4H3
InChIKey
SLWHBWPEIAHTMP-UHFFFAOYSA-N
Synonyms
299452-17-8
299452178
CCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OCC)OC)C(=O)CCC2)C
InChI=1SC23H29NO5c15122923(26)2014(3)241687917(25)22(16)21(20)15101118(2862)19(1315)274h1011132124H5912H214H3
MFCD00753322
propyl4(4ethoxy3methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
propyl4(4ethoxy3methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
ZINC000002801330
ZINC000002801331

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Available files

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