Vitas-M small molecule compound
2-ethoxyethyl 7-(4-chlorophenyl)-4-(4-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK097838
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)O)C(=O)CC(C2)c1ccc(cc1)Cl
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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 C27H28ClNO5 MW 481.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28ClNO5/c1-3-33-12-13-34-27(32)24-16(2)29-22-14-19(17-4-8-20(28)9-5-17)15-23(31)26(22)25(24)18-6-10-21(30)11-7-18/h4-11,19,25,29-30H,3,12-15H2,1-2H3InChIKey
MOLQEUSHGNLMQX-UHFFFAOYSA-NSynonyms
2ethoxyethyl7(4chlorophenyl)4(4hydroxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2ethoxyethyl7(4chlorophenyl)4(4hydroxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)O)C(=O)CC(C2)c1ccc(cc1)Cl
CCOCCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)O)C(=O)CC(C2)C4=CC=C(C=C4)Cl)C
InChI=1SC27H28ClNO5c133312133427(32)2416(2)29221419(174820(28)9517)1523(31)26(22)25(24)1861021(30)11718h41119252930H31215H212H3
MFCD01824446
STK097838
ZINC000002757691
ZINC000002757694
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