Vitas-M small molecule compound
2-phenoxyethyl 4-(3-bromophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK037881
SMILES Brc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCCOc1ccccc1
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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 C25H24BrNO4 MW 482.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24BrNO4/c1-16-22(25(29)31-14-13-30-19-9-3-2-4-10-19)23(17-7-5-8-18(26)15-17)24-20(27-16)11-6-12-21(24)28/h2-5,7-10,15,23,27H,6,11-14H2,1H3InChIKey
AKGBUWWALOVERH-UHFFFAOYSA-NSynonyms
2phenoxyethyl4(3bromophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl4(3bromophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
Brc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCCOc1ccccc1
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=CC=C3)Br)C(=O)OCCOC4=CC=CC=C4
InChI=1SC25H24BrNO4c11622(25(29)311413301993241019)23(1775818(26)1517)2420(2716)1161221(24)28h25710152327H61114H21H3
MFCD02188654
STK037881
ZINC000002190463
ZINC000002190464
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