Vitas-M small molecule compound
pentyl 4-(2,3-dichlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372622
SMILES CCCCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1Cl)Cl)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 C22H25Cl2NO3 MW 422.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25Cl2NO3/c1-3-4-5-12-28-22(27)18-13(2)25-16-10-7-11-17(26)20(16)19(18)14-8-6-9-15(23)21(14)24/h6,8-9,19,25H,3-5,7,10-12H2,1-2H3InChIKey
IABHNQFXUFEWBC-UHFFFAOYSA-NSynonyms
299948-63-3299948633
CCCCCOC(=O)C1=C(NC2=C(C1C3=C(C(=CC=C3)Cl)Cl)C(=O)CCC2)C
InChI=1SC22H25Cl2NO3c1345122822(27)1813(2)25161071117(26)20(16)19(18)1486915(23)21(14)24h6891925H3571012H212H3
MFCD00753332
pentyl4(23dichlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
pentyl4(23dichlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
ZINC000002055429
ZINC000002055430
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