Vitas-M small molecule compound
benzyl 4-(4-ethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK089948
SMILES CCOc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCc1ccccc1
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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 C26H27NO4 MW 417.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO4/c1-3-30-20-14-12-19(13-15-20)24-23(26(29)31-16-18-8-5-4-6-9-18)17(2)27-21-10-7-11-22(28)25(21)24/h4-6,8-9,12-15,24,27H,3,7,10-11,16H2,1-2H3InChIKey
FYNRXLZCUPAZQT-UHFFFAOYSA-NSynonyms
299453-79-5299453795
benzyl4(4ethoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
benzyl4(4ethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCOC1=CC=C(C=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OCC4=CC=CC=C4)C
CCOc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCc1ccccc1
InChI=1SC26H27NO4c133020141219(131520)2423(26(29)3116188546918)17(2)27211071122(28)25(21)24h468912152427H37101116H212H3
MFCD00771226
STK089948
ZINC000000853739
ZINC000000853740
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