Vitas-M small molecule compound
butyl 4-(2,3-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK043207
SMILES CCCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1Cl)Cl)C(=O)CC(C2)(C)C
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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 C23H27Cl2NO3 MW 436.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27Cl2NO3/c1-5-6-10-29-22(28)18-13(2)26-16-11-23(3,4)12-17(27)20(16)19(18)14-8-7-9-15(24)21(14)25/h7-9,19,26H,5-6,10-12H2,1-4H3InChIKey
AESGGEWVVJMBOS-UHFFFAOYSA-NSynonyms
butyl4(23dichlorophenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
butyl4(23dichlorophenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
CCCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1Cl)Cl)C(=O)CC(C2)(C)C
CCCCOC(=O)C1=C(NC2=C(C1C3=C(C(=CC=C3)Cl)Cl)C(=O)CC(C2)(C)C)C
InChI=1SC23H27Cl2NO3c156102922(28)1813(2)26161123(34)1217(27)20(16)19(18)1487915(24)21(14)25h791926H561012H214H3
MFCD00752940
STK043207
ZINC000002055107
ZINC000002055108
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