Vitas-M small molecule compound
2-phenoxyethyl 4-(2-bromophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK076205
SMILES O=C(C1=C(C)NC2=C(C1c1ccccc1Br)C(=O)CCC2)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)31-15-14-30-17-8-3-2-4-9-17)23(18-10-5-6-11-19(18)26)24-20(27-16)12-7-13-21(24)28/h2-6,8-11,23,27H,7,12-15H2,1H3InChIKey
MGHOBQGDYZDQFO-UHFFFAOYSA-NSynonyms
2phenoxyethyl4(2bromophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl4(2bromophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=CC=C3Br)C(=O)OCCOC4=CC=CC=C4
InChI=1SC25H24BrNO4c11622(25(29)31151430178324917)23(1810561119(18)26)2420(2716)1271321(24)28h268112327H71215H21H3
MFCD02104393
O=C(C1=C(C)NC2=C(C1c1ccccc1Br)C(=O)CCC2)OCCOc1ccccc1
STK076205
ZINC000002775417
ZINC000002775418
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