Vitas-M small molecule compound
butyl 4-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK040105
SMILES CCCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OC)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 C23H29NO5 MW 399.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO5/c1-5-6-12-29-23(26)20-14(2)24-16-8-7-9-17(25)22(16)21(20)15-10-11-18(27-3)19(13-15)28-4/h10-11,13,21,24H,5-9,12H2,1-4H3InChIKey
VDLSHUFCQCLSKO-UHFFFAOYSA-NSynonyms
butyl4(34dimethoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
butyl4(34dimethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OC)C(=O)CCC2
CCCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OC)OC)C(=O)CCC2)C
InChI=1SC23H29NO5c156122923(26)2014(2)241687917(25)22(16)21(20)15101118(273)19(1315)284h1011132124H5912H214H3
MFCD00753398
STK040105
ZINC000002055493
ZINC000002055494
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