Vitas-M small molecule compound
butyl 4-(4-iodophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372385
SMILES CCCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)I)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)23-16-6-5-7-17(24)20(16)19(18)14-8-10-15(22)11-9-14/h8-11,19,23H,3-7,12H2,1-2H3InChIKey
YECATZMABBKWPP-UHFFFAOYSA-NSynonyms
butyl4(4iodophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
butyl4(4iodophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCCCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)I)C(=O)CCC2)C
InChI=1SC21H24INO3c134122621(25)1813(2)231665717(24)20(16)19(18)1481015(22)11914h8111923H3712H212H3
MFCD00753080
ZINC000003094395
ZINC000003094396
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