Vitas-M small molecule compound
2-ethoxyethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363325
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1cc(Br)c(c(c1)OCC)O)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 C23H28BrNO6 MW 494.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28BrNO6/c1-4-29-9-10-31-23(28)19-13(3)25-16-7-6-8-17(26)21(16)20(19)14-11-15(24)22(27)18(12-14)30-5-2/h11-12,20,25,27H,4-10H2,1-3H3InChIKey
YXOTVJAUQGBPDI-UHFFFAOYSA-NSynonyms
313244-28-92ethoxyethyl4(3bromo5ethoxy4hydroxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2ethoxyethyl4(3bromo5ethoxy4hydroxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
313244289
CCOCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C(=C3)Br)O)OCC)C(=O)CCC2)C
InChI=1SC23H28BrNO6c14299103123(28)1913(3)251676817(26)21(16)20(19)141115(24)22(27)18(1214)3052h1112202527H410H213H3
MFCD01367196
ZINC000002082123
ZINC000002082124
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