Vitas-M small molecule compound
2-propoxyethyl 4-(3-bromophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK049467
SMILES CCCOCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)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 C22H26BrNO4 MW 448.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26BrNO4/c1-3-10-27-11-12-28-22(26)19-14(2)24-17-8-5-9-18(25)21(17)20(19)15-6-4-7-16(23)13-15/h4,6-7,13,20,24H,3,5,8-12H2,1-2H3InChIKey
RKCDYEZROCSWSM-UHFFFAOYSA-NSynonyms
2propoxyethyl4(3bromophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2propoxyethyl4(3bromophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCCOCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)Br)C(=O)CCC2
CCCOCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)Br)C(=O)CCC2)C
InChI=1SC22H26BrNO4c13102711122822(26)1914(2)241785918(25)21(17)20(19)1564716(23)1315h467132024H35812H212H3
MFCD02188642
STK049467
ZINC000002190626
ZINC000002190627
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