Vitas-M small molecule compound

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

Catalog ID
STK371801
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)Br)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 C19H20BrNO3 MW 390.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20BrNO3/c1-3-24-19(23)16-11(2)21-14-5-4-6-15(22)18(14)17(16)12-7-9-13(20)10-8-12/h7-10,17,21H,3-6H2,1-2H3
InChIKey
TZBCXXVHPAQBPS-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)Br)C(=O)CCC2)C
ethyl4(4bromophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
ethyl4(4bromophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC19H20BrNO3c132419(23)1611(2)211454615(22)18(14)17(16)127913(20)10812h7101721H36H212H3
MFCD00619430
ZINC000020609402
ZINC000020609403

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Available files

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