Vitas-M small molecule compound

butyl 4-(2-iodophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK372383
SMILES CCCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1I)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 C21H24INO3 MW 465.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24INO3/c1-3-4-12-26-21(25)18-13(2)23-16-10-7-11-17(24)20(16)19(18)14-8-5-6-9-15(14)22/h5-6,8-9,19,23H,3-4,7,10-12H2,1-2H3
InChIKey
DTHCHYDTXBBYME-UHFFFAOYSA-N
Synonyms

butyl4(2iodophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
butyl4(2iodophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCCCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3I)C(=O)CCC2)C
InChI=1SC21H24INO3c134122621(25)1813(2)23161071117(24)20(16)19(18)14856915(14)22h56891923H3471012H212H3
MFCD00771082
ZINC000003098433
ZINC000003098434

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Available files

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