Vitas-M small molecule compound
methyl 4-(4-iodophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372361
SMILES COC(=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 C18H18INO3 MW 423.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18INO3/c1-10-15(18(22)23-2)16(11-6-8-12(19)9-7-11)17-13(20-10)4-3-5-14(17)21/h6-9,16,20H,3-5H2,1-2H3InChIKey
MMMTUZMYSSZTSB-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)I)C(=O)OC
InChI=1SC18H18INO3c11015(18(22)232)16(116812(19)9711)1713(2010)43514(17)21h691620H35H212H3
methyl4(4iodophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(4iodophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD00717829
ZINC000019535783
ZINC000019535786
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