Vitas-M small molecule compound

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

Catalog ID
STK061752
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)Cl)Cl)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 C19H19Cl2NO3 MW 380.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19Cl2NO3/c1-3-25-19(24)16-10(2)22-14-5-4-6-15(23)18(14)17(16)11-7-8-12(20)13(21)9-11/h7-9,17,22H,3-6H2,1-2H3
InChIKey
JZEGZNNTOQMALZ-UHFFFAOYSA-N
Synonyms
5478-25-1
5478251
CCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)Cl)Cl)C(=O)CCC2
CCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)Cl)Cl)C(=O)CCC2)C
ethyl4(34dichlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
ethyl4(34dichlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC19H19Cl2NO3c132519(24)1610(2)221454615(23)18(14)17(16)117812(20)13(21)911h791722H36H212H3
MFCD00619433
STK061752
ZINC000004759914
ZINC000013286629

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Available files

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