Vitas-M small molecule compound
prop-2-en-1-yl 4-(4-iodophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372640
SMILES C=CCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)I)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 C22H24INO3 MW 477.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24INO3/c1-5-10-27-21(26)18-13(2)24-16-11-22(3,4)12-17(25)20(16)19(18)14-6-8-15(23)9-7-14/h5-9,19,24H,1,10-12H2,2-4H3InChIKey
DLLWCWKFNUNJPT-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)I)C(=O)OCC=C
InChI=1SC22H24INO3c15102721(26)1813(2)24161122(34)1217(25)20(16)19(18)146815(23)9714h591924H11012H224H3
MFCD00717985
prop2en1yl4(4iodophenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
prop2enyl4(4iodophenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
ZINC000002055475
ZINC000002055476
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